diff --git a/scripts/LRE_config_overlaps.json b/scripts/LRE_config_overlaps.json
index d1a4ac2..1af037f 100644
--- a/scripts/LRE_config_overlaps.json
+++ b/scripts/LRE_config_overlaps.json
@@ -4,7 +4,7 @@
     "overlap_csv": "overlaps.csv",
     "sf_threshold": 1e-12,
     "df_threshold": 1e-3,
-    "max_orbitals": 32
+    "max_orbitals": 1000
   },
   "algorithm_description": "Double factorized QPE resource estimates based on methodology of arXiv:2406.06335. Note that the truncation error is not included in the error bounds and that the SCF compute time is not included in the preprocessing time. Ground-state overlap is taken to be that estimated for the dominant CSF as estimated by DMRG and that this DMRG runtime is not included in the classical compute costs.",
   "contact_info": [
diff --git a/scripts/compute_all_LREs_scripts.log.txt b/scripts/compute_all_LREs_scripts.log.txt
index 80ba9d2..e35fb9b 100644
--- a/scripts/compute_all_LREs_scripts.log.txt
+++ b/scripts/compute_all_LREs_scripts.log.txt
@@ -1,5822 +1,42 @@
-2024-12-13 23:10:56,630 - INFO - ===============================================
-2024-12-13 23:10:56,630 - INFO - overall start time: 2024-12-13 23:10:56.630159
-2024-12-13 23:10:56,630 - INFO - input directory: ../problem_instances/
-2024-12-13 23:10:56,630 - INFO - parsing 82 files in the input directory
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.cl2_0.0e393c20-3915-42b9-a8aa-29bf53548269.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.Cu_0.1448d27d-bfa9-470f-a6c8-864a295b66f4.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.si2_h6_0.0c1dfb55-f021-409a-80b1-79c8c2908095.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.blue_dimer.dc8bdc56-5ebd-4996-6b81-81b1a06d8c76.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.benzene.f377cc27-366a-45af-b45a-c8478e4b6199.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.Cr_1.02a8c4e9-9d15-4742-b4cc-7f47f69da0e5.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.Ti_1.9823b0dd-87b6-4793-9741-e8cbcf2b50c0.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.V_0.a14a1e28-71c5-4e23-bf6e-dd9662a6df58.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.CuO_0.886ad5bf-d487-48c8-b08c-c9f82b84ed5d.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.TiO_0.0b91f99e-8de5-415d-a78e-f80e45d621ca.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.na2_0.edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.mn_mono.cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.FeO_0.55d0ed82-0560-4448-8459-c2ba00654d9d.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.p_h3_0.0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.h2_s_0.208f2e50-2b56-4e72-815a-cba5cec1264c.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Sc_0.67f72316-2262-44fb-8c0a-e159e1cd0cf0.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.na_cl_0.3f141f05-532b-478d-b38a-2ae07baadc88.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.c2_h2_0.0ca102a7-dad4-4d42-8c73-9acfa45378d7.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.li_f_0.e48e7467-1fcd-478b-a599-f4ce881c57b9.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.h2_c_o_0.25fd617b-8e7f-4422-9e97-cc3f6b0d3876.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0011.766ba2da-e72a-4e03-a739-f97269026fc4.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Mn_0.bc202949-d76c-4962-b937-5c12b298b8b4.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0008.b57eb979-5c09-4974-97b4-5862e109a1ae.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.mo_n2.664ec8e4-09d5-41cc-6266-ddb26219366f.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.li_h_0.6d355019-13aa-41fc-a530-31d5f968ba22.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.li2_0.3301a356-21a9-472b-8021-f02f4d2c9eec.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.h_f_0.892e3341-7186-44c6-9a1a-20f270ddc8b8.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Fe_0.05abb33d-ecea-406f-8832-31a814b26dfd.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0010.bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.ru_macho.b78a10f2-ce8a-43c0-69ec-4cf666d8e85c.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Cu_1.d5c7ab73-dfc1-499e-9027-601476004107.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.n_h3_0.127cfea5-8a7d-45a0-9012-949816a0b8d9.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0006.42958a3e-8b35-4992-acd8-6711848066c1.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.n2_h4_0.f1a6b508-75e8-4afb-9c81-fc61af11b523.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.c2_h4_0.9fbd9b4c-5ea9-4095-af7b-7d4491399e42.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.O_1.d712afaf-6ec4-42d9-b5fd-1edee3ec1046.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.cr_dimer.8ed1a800-a4c6-4bff-a6de-cb220554c42f.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.be_0.19cada59-64cc-466c-8809-782a4f574dcc.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.f2_0.e3e78b41-577d-4536-a63f-7e968eeb6493.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.n2_0.9bd9cde6-6daa-441a-984e-ae1c1c051e91.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.fe_red.a8895776-3583-4884-fbc7-d6f9df21a7ac.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Fe_1.33c9a058-7a67-454c-856c-2519ba55b44d.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.ScO_0.7437abf0-1394-47ce-9218-d181f1732112.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0003.a37c86c0-1937-4f05-83ab-08a5fd104b7e.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.h_c_n_0.8846a90e-96cb-4bc3-ad06-5388212f728e.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.si_h4_0.13c7144d-047e-4431-8d02-0b1d14c0526b.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0009.8db449b1-265b-4a66-b965-a2b4833a88d1.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Mn_1.11c8be98-d9c9-40ea-8d88-ea8c555028f6.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.c_h3_cl_0.379781b8-5732-492e-9fca-6fad3fc3692a.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.p2_0.2e61ba35-b6b0-42b5-b3e8-d25bd83145ba.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.si_o_0.68f1a091-8652-4095-ba31-56f0e02e27d3.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h2_o_0.9b8083ab-ea59-47db-894c-95a0d2ba3cb6.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h_o_cl_0.ea2e13c5-6d80-466e-bd6b-6289e10ed82b.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c2_h6_0.b1c5ac4e-9b94-4e89-9557-da2026933172.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0001.3d3b9e8a-7842-4ca1-bd82-eddb9804972d.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_h4_0.e0f6ed02-6502-454b-bf2c-e7994e0510f4.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.V_1.18e1973e-d6cf-48d6-9ca4-c1af21ff7c98.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0007.3aaf0bb4-b412-4746-922a-c380b4024d00.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.Ti_0.c1e4c7dd-2dc4-4dd0-889d-fb34f602965a.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.CrO_0.2140edd4-8eb3-4270-b753-278334998e3d.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0002.00043d56-ed63-4266-907c-99c95c51b9db.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h3_c_o_h_0.5524b5e5-adba-4322-9808-69e75e4335b2.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.Cr_0.b8fe08a4-82fe-4636-9812-b1e0666f95b5.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h2_o2_0.cc7044d7-28e0-4fe2-bd6b-c9c758da4776.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_o_0.1c3155e0-3679-4eff-bed0-57a1082672c3.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.si_h2_singlet_0.a0a07bfe-aac2-4d61-9425-009953899b3b.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_s_0.f90280cc-c860-4ff1-a9ec-4841cec989f7.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h3_c_s_h_0.674b572a-3d6d-4418-8cc2-4755d90367ee.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h_cl_0.586ce6a9-1876-459e-9b6c-be8bb1c4d1a5.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.s_o2_0.1d0b8322-24b3-407a-8246-07444bb020be.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0004.e0adafc5-789e-43e6-8f9e-e718da28de3a.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.O_0.162f41da-af43-427c-a8bc-ae9fa97ace95.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.ozone.9560107e-f1ad-4480-aa51-ef03edda6e19.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_h2_singlet_0.7ca1486c-06a5-47c1-b8ab-eab491ffc68b.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.VO_0.bcc86483-2a7e-4271-b6fc-238ef5e682f6.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0005.7e0fb928-b0a9-4b44-89f1-7e0ee3b2bb13.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.ru_mono.7213642b-5f16-48be-d5e5-2bc42ebb8526.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.mo2_n2.90d4e4fc-1216-4846-b45f-198c0530e29b.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.MnO_0.e2212cdf-adef-454a-b218-05041d723c55.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.mo_n2_pincer.8a3787cc-d3d0-42a8-d9a9-7de2aed45208.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_o2_0.3987b2dd-25bc-44e2-b516-dbc3f670a9c3.json
-2024-12-13 23:10:56,632 - INFO - parsing ../problem_instances/problem_instance.cl2_0.0e393c20-3915-42b9-a8aa-29bf53548269.json
-2024-12-13 23:10:56,633 - INFO - problem_instance UUID: 0e393c20-3915-42b9-a8aa-29bf53548269
-2024-12-13 23:10:56,633 - INFO - problem_instance short name: cl2_0
-2024-12-13 23:10:56,633 - INFO - contains 3 associated Hamiltonians.
-2024-12-13 23:10:56,667 - INFO - Analyzing task c01649e2-8c5c-4827-a037-1ede2159e558...
-2024-12-13 23:10:56,668 - INFO - number of supporting files: 2
-2024-12-13 23:10:56,668 - INFO - supporting data file UUID: 8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.
-2024-12-13 23:10:56,668 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz.
-2024-12-13 23:10:56,668 - INFO - assuming fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz is an FCIDUMP file.
-2024-12-13 23:10:56,668 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz...
-2024-12-13 23:10:56,674 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:10:57,255 - INFO - Authentication (publickey) successful!
-2024-12-13 23:10:57,269 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:10:57,417 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:10:58,066 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:10:58,066 - INFO - supporting data file UUID: 5277b7f4-854c-45a4-a98e-95db9b40c071.
-2024-12-13 23:10:58,066 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVDZ.5277b7f4-854c-45a4-a98e-95db9b40c071.chk.
-2024-12-13 23:10:58,066 - INFO - assuming cl2_cc-pVDZ.5277b7f4-854c-45a4-a98e-95db9b40c071.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:10:58,066 - INFO - Analyzing task 214bb702-d7bc-4141-8cf3-f6979ba0f67a...
-2024-12-13 23:10:58,066 - INFO - number of supporting files: 2
-2024-12-13 23:10:58,066 - INFO - supporting data file UUID: 7b8c2dbd-8966-4eb4-83af-8acb07454e8a.
-2024-12-13 23:10:58,066 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz.
-2024-12-13 23:10:58,066 - INFO - assuming fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz is an FCIDUMP file.
-2024-12-13 23:10:58,066 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz...
-2024-12-13 23:10:58,070 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:10:58,600 - INFO - Authentication (publickey) successful!
-2024-12-13 23:10:58,614 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:14:20,900 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:15:23,485 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-13 23:15:23,485 - INFO - supporting data file UUID: dba5899f-164d-4e94-85f7-a1d8757179ab.
-2024-12-13 23:15:23,485 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVQZ.dba5899f-164d-4e94-85f7-a1d8757179ab.chk.
-2024-12-13 23:15:23,485 - INFO - assuming cl2_cc-pVQZ.dba5899f-164d-4e94-85f7-a1d8757179ab.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:15:23,485 - INFO - Analyzing task 35e4c771-0f4f-4413-b42f-132f1e606cb0...
-2024-12-13 23:15:23,485 - INFO - number of supporting files: 2
-2024-12-13 23:15:23,485 - INFO - supporting data file UUID: 781d0704-7a95-4183-9c50-cbdbd976884a.
-2024-12-13 23:15:23,485 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz.
-2024-12-13 23:15:23,486 - INFO - assuming fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz is an FCIDUMP file.
-2024-12-13 23:15:23,486 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz...
-2024-12-13 23:15:23,491 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:15:23,998 - INFO - Authentication (publickey) successful!
-2024-12-13 23:15:24,011 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:15:27,388 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:15:35,743 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-13 23:15:35,743 - INFO - supporting data file UUID: 27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.
-2024-12-13 23:15:35,743 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVTZ.27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.chk.
-2024-12-13 23:15:35,743 - INFO - assuming cl2_cc-pVTZ.27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:15:35,750 - INFO - parsing ../problem_instances/problem_instance.Cu_0.1448d27d-bfa9-470f-a6c8-864a295b66f4.json
-2024-12-13 23:15:35,750 - INFO - problem_instance UUID: 1448d27d-bfa9-470f-a6c8-864a295b66f4
-2024-12-13 23:15:35,750 - INFO - problem_instance short name: Cu_0
-2024-12-13 23:15:35,751 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:15:35,762 - INFO - Analyzing task 7f0518e8-e2c8-4912-8268-4de4cd504084...
-2024-12-13 23:15:35,762 - INFO - number of supporting files: 2
-2024-12-13 23:15:35,763 - INFO - supporting data file UUID: 48434e2f-f09e-474e-b98c-af180386a258.
-2024-12-13 23:15:35,763 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz.
-2024-12-13 23:15:35,763 - INFO - assuming fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz is an FCIDUMP file.
-2024-12-13 23:15:35,763 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz...
-2024-12-13 23:15:35,768 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:15:36,272 - INFO - Authentication (publickey) successful!
-2024-12-13 23:15:36,285 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:15:36,918 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:15:40,311 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-13 23:15:40,311 - INFO - supporting data file UUID: 08885387-3319-4489-9487-56a333abf06b.
-2024-12-13 23:15:40,311 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu0_vdz.08885387-3319-4489-9487-56a333abf06b.chk.
-2024-12-13 23:15:40,311 - INFO - assuming Cu0_vdz.08885387-3319-4489-9487-56a333abf06b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:15:40,311 - INFO - Analyzing task 0f5171c4-cf55-4a82-99a2-c72edebce9c9...
-2024-12-13 23:15:40,311 - INFO - number of supporting files: 2
-2024-12-13 23:15:40,311 - INFO - supporting data file UUID: e304b6b5-b820-470d-a8b5-92d6354abd16.
-2024-12-13 23:15:40,311 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz.
-2024-12-13 23:15:40,311 - INFO - assuming fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz is an FCIDUMP file.
-2024-12-13 23:15:40,311 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz...
-2024-12-13 23:15:40,318 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:15:40,977 - INFO - Authentication (publickey) successful!
-2024-12-13 23:15:40,992 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:16:02,852 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:16:25,091 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-13 23:16:25,091 - INFO - supporting data file UUID: 34a02644-d0a3-4e3b-987c-c7962587f41a.
-2024-12-13 23:16:25,091 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu0_vtz.34a02644-d0a3-4e3b-987c-c7962587f41a.chk.
-2024-12-13 23:16:25,091 - INFO - assuming Cu0_vtz.34a02644-d0a3-4e3b-987c-c7962587f41a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:16:25,095 - INFO - parsing ../problem_instances/problem_instance.si2_h6_0.0c1dfb55-f021-409a-80b1-79c8c2908095.json
-2024-12-13 23:16:25,096 - INFO - problem_instance UUID: 0c1dfb55-f021-409a-80b1-79c8c2908095
-2024-12-13 23:16:25,096 - INFO - problem_instance short name: si2_h6_0
-2024-12-13 23:16:25,096 - INFO - contains 1 associated Hamiltonians.
-2024-12-13 23:16:25,111 - INFO - Analyzing task 109f95c5-8561-458c-8f41-72be596b87e6...
-2024-12-13 23:16:25,111 - INFO - number of supporting files: 2
-2024-12-13 23:16:25,111 - INFO - supporting data file UUID: bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.
-2024-12-13 23:16:25,111 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz.
-2024-12-13 23:16:25,111 - INFO - assuming fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz is an FCIDUMP file.
-2024-12-13 23:16:25,111 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz...
-2024-12-13 23:16:25,117 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:16:25,655 - INFO - Authentication (publickey) successful!
-2024-12-13 23:16:25,674 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:16:33,151 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:16:44,715 - INFO - Skipping Logical Resource Estimate because number of orbitals (66) exceeds maximum specified in config (32).
-2024-12-13 23:16:44,716 - INFO - supporting data file UUID: 6494dcb3-de3a-4bd2-bd92-a121241b95aa.
-2024-12-13 23:16:44,716 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si2_h6_cc-pVDZ.6494dcb3-de3a-4bd2-bd92-a121241b95aa.chk.
-2024-12-13 23:16:44,716 - INFO - assuming si2_h6_cc-pVDZ.6494dcb3-de3a-4bd2-bd92-a121241b95aa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:16:44,717 - INFO - parsing ../problem_instances/problem_instance.blue_dimer.dc8bdc56-5ebd-4996-6b81-81b1a06d8c76.json
-2024-12-13 23:16:44,718 - INFO - problem_instance UUID: dc8bdc56-5ebd-4996-6b81-81b1a06d8c76
-2024-12-13 23:16:44,718 - INFO - problem_instance short name: blue_dimer
-2024-12-13 23:16:44,718 - INFO - contains 12 associated Hamiltonians.
-2024-12-13 23:16:44,730 - INFO - Analyzing task 9da97ef6-4bad-4c82-8576-9b8e539a7ba8...
-2024-12-13 23:16:44,730 - INFO - number of supporting files: 1
-2024-12-13 23:16:44,731 - INFO - supporting data file UUID: 46967cfc-d867-40e8-bef0-9655c46cef29.
-2024-12-13 23:16:44,731 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz.
-2024-12-13 23:16:44,731 - INFO - assuming fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz is an FCIDUMP file.
-2024-12-13 23:16:44,731 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz...
-2024-12-13 23:16:44,739 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:16:45,247 - INFO - Authentication (publickey) successful!
-2024-12-13 23:16:45,276 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:16:45,638 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:16:45,678 - INFO - ===============================================
-2024-12-13 23:16:45,678 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:18:10,667 - INFO - Circuit initialization time: 84.989086 seconds.
-2024-12-13 23:18:10,667 - INFO - Estimating logical resources...
-2024-12-13 23:18:20,529 - INFO - Resource estimation time (seconds): 9.861621
-2024-12-13 23:18:20,529 - INFO - Analyzing task f20db1b1-86e3-4ddf-96ff-a6d37f331935...
-2024-12-13 23:18:20,529 - INFO - number of supporting files: 1
-2024-12-13 23:18:20,529 - INFO - supporting data file UUID: 85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.
-2024-12-13 23:18:20,529 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz.
-2024-12-13 23:18:20,529 - INFO - assuming fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz is an FCIDUMP file.
-2024-12-13 23:18:20,529 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz...
-2024-12-13 23:18:20,534 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:18:21,053 - INFO - Authentication (publickey) successful!
-2024-12-13 23:18:21,068 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:18:21,124 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:18:21,227 - INFO - ===============================================
-2024-12-13 23:18:21,227 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:19:14,917 - INFO - Circuit initialization time: 53.689933 seconds.
-2024-12-13 23:19:14,917 - INFO - Estimating logical resources...
-2024-12-13 23:19:24,273 - INFO - Resource estimation time (seconds): 9.355477
-2024-12-13 23:19:24,273 - INFO - Analyzing task 742be33c-0982-4b06-b324-1d86242e28d9...
-2024-12-13 23:19:24,273 - INFO - number of supporting files: 1
-2024-12-13 23:19:24,273 - INFO - supporting data file UUID: 7db0f859-073f-46af-9325-016a67229a4b.
-2024-12-13 23:19:24,273 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz.
-2024-12-13 23:19:24,273 - INFO - assuming fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz is an FCIDUMP file.
-2024-12-13 23:19:24,273 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz...
-2024-12-13 23:19:24,278 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:19:24,806 - INFO - Authentication (publickey) successful!
-2024-12-13 23:19:24,820 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:19:24,921 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:19:25,348 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-13 23:19:25,348 - INFO - Analyzing task 3b49563d-948a-4ecb-84a0-d3c0c2c0d217...
-2024-12-13 23:19:25,348 - INFO - number of supporting files: 1
-2024-12-13 23:19:25,348 - INFO - supporting data file UUID: 2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.
-2024-12-13 23:19:25,348 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz.
-2024-12-13 23:19:25,348 - INFO - assuming fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz is an FCIDUMP file.
-2024-12-13 23:19:25,348 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz...
-2024-12-13 23:19:25,353 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:19:25,888 - INFO - Authentication (publickey) successful!
-2024-12-13 23:19:25,903 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:19:26,012 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:19:26,559 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:19:26,559 - INFO - Analyzing task 950da653-13ce-4cd7-95d8-5045ab03d4bc...
-2024-12-13 23:19:26,559 - INFO - number of supporting files: 1
-2024-12-13 23:19:26,559 - INFO - supporting data file UUID: a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.
-2024-12-13 23:19:26,559 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz.
-2024-12-13 23:19:26,559 - INFO - assuming fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz is an FCIDUMP file.
-2024-12-13 23:19:26,559 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz...
-2024-12-13 23:19:26,564 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:19:27,094 - INFO - Authentication (publickey) successful!
-2024-12-13 23:19:27,110 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:19:27,160 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:19:27,197 - INFO - ===============================================
-2024-12-13 23:19:27,198 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:19:51,214 - INFO - Circuit initialization time: 24.016083 seconds.
-2024-12-13 23:19:51,214 - INFO - Estimating logical resources...
-2024-12-13 23:19:56,190 - INFO - Resource estimation time (seconds): 4.975797
-2024-12-13 23:19:56,190 - INFO - Analyzing task 13821f5c-78a6-485c-9006-a17a234cde9f...
-2024-12-13 23:19:56,190 - INFO - number of supporting files: 1
-2024-12-13 23:19:56,190 - INFO - supporting data file UUID: d9707874-28d5-48b6-824e-a2e6c8753437.
-2024-12-13 23:19:56,190 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz.
-2024-12-13 23:19:56,190 - INFO - assuming fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz is an FCIDUMP file.
-2024-12-13 23:19:56,190 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz...
-2024-12-13 23:19:56,198 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:19:56,689 - INFO - Authentication (publickey) successful!
-2024-12-13 23:19:56,707 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:19:56,769 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:19:56,848 - INFO - ===============================================
-2024-12-13 23:19:56,848 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:20:50,528 - INFO - Circuit initialization time: 53.679979 seconds.
-2024-12-13 23:20:50,528 - INFO - Estimating logical resources...
-2024-12-13 23:20:59,906 - INFO - Resource estimation time (seconds): 9.377233
-2024-12-13 23:20:59,906 - INFO - Analyzing task 765594e5-44ac-41a2-89a7-f2ac03536379...
-2024-12-13 23:20:59,906 - INFO - number of supporting files: 1
-2024-12-13 23:20:59,906 - INFO - supporting data file UUID: 727ab190-e399-4bb6-a9b3-20ae57789bac.
-2024-12-13 23:20:59,906 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz.
-2024-12-13 23:20:59,906 - INFO - assuming fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz is an FCIDUMP file.
-2024-12-13 23:20:59,906 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz...
-2024-12-13 23:20:59,911 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:21:00,432 - INFO - Authentication (publickey) successful!
-2024-12-13 23:21:00,449 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:21:00,573 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:21:01,004 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-13 23:21:01,004 - INFO - Analyzing task 858b9683-fc6c-4ebe-8c33-27f0d848f24f...
-2024-12-13 23:21:01,004 - INFO - number of supporting files: 1
-2024-12-13 23:21:01,004 - INFO - supporting data file UUID: e986eb83-6b9d-439e-85ca-a9b931eef4a2.
-2024-12-13 23:21:01,004 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz.
-2024-12-13 23:21:01,004 - INFO - assuming fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz is an FCIDUMP file.
-2024-12-13 23:21:01,004 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz...
-2024-12-13 23:21:01,009 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:21:01,551 - INFO - Authentication (publickey) successful!
-2024-12-13 23:21:01,570 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:21:01,680 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:21:02,268 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:21:02,268 - INFO - Analyzing task 1a013e9f-7eab-4a1b-b486-1d9e2d99e754...
-2024-12-13 23:21:02,268 - INFO - number of supporting files: 1
-2024-12-13 23:21:02,268 - INFO - supporting data file UUID: 6bf3207c-664b-4ed3-8e74-82b42e277234.
-2024-12-13 23:21:02,268 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz.
-2024-12-13 23:21:02,268 - INFO - assuming fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz is an FCIDUMP file.
-2024-12-13 23:21:02,268 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz...
-2024-12-13 23:21:02,273 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:21:02,793 - INFO - Authentication (publickey) successful!
-2024-12-13 23:21:02,806 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:21:02,869 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:21:02,913 - INFO - ===============================================
-2024-12-13 23:21:02,913 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:21:32,811 - INFO - Circuit initialization time: 29.89798 seconds.
-2024-12-13 23:21:32,811 - INFO - Estimating logical resources...
-2024-12-13 23:21:38,456 - INFO - Resource estimation time (seconds): 5.644822
-2024-12-13 23:21:38,456 - INFO - Analyzing task 001a0d11-165a-49c5-a334-643023029f40...
-2024-12-13 23:21:38,456 - INFO - number of supporting files: 1
-2024-12-13 23:21:38,456 - INFO - supporting data file UUID: fb3ecfad-6450-423e-aa58-d5cddab6f0f6.
-2024-12-13 23:21:38,456 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz.
-2024-12-13 23:21:38,457 - INFO - assuming fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz is an FCIDUMP file.
-2024-12-13 23:21:38,457 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz...
-2024-12-13 23:21:38,461 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:21:38,966 - INFO - Authentication (publickey) successful!
-2024-12-13 23:21:38,979 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:21:39,049 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:21:39,252 - INFO - ===============================================
-2024-12-13 23:21:39,253 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:24:03,647 - INFO - Circuit initialization time: 144.394194 seconds.
-2024-12-13 23:24:03,647 - INFO - Estimating logical resources...
-2024-12-13 23:24:24,591 - INFO - Resource estimation time (seconds): 20.94351
-2024-12-13 23:24:24,591 - INFO - Analyzing task 1c9508e3-b9fe-44f1-ae58-c6339ef43f47...
-2024-12-13 23:24:24,592 - INFO - number of supporting files: 1
-2024-12-13 23:24:24,592 - INFO - supporting data file UUID: dc406285-bac1-4b99-afbf-06728b7d699b.
-2024-12-13 23:24:24,592 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz.
-2024-12-13 23:24:24,592 - INFO - assuming fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz is an FCIDUMP file.
-2024-12-13 23:24:24,592 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz...
-2024-12-13 23:24:24,598 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:24:25,142 - INFO - Authentication (publickey) successful!
-2024-12-13 23:24:25,157 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:24:25,266 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:24:25,729 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-13 23:24:25,729 - INFO - Analyzing task 6713517a-ab65-4381-aae1-0839dcd6c1a0...
-2024-12-13 23:24:25,729 - INFO - number of supporting files: 1
-2024-12-13 23:24:25,729 - INFO - supporting data file UUID: af9d6a83-7898-4c13-80eb-a83a533ebf2d.
-2024-12-13 23:24:25,729 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz.
-2024-12-13 23:24:25,729 - INFO - assuming fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz is an FCIDUMP file.
-2024-12-13 23:24:25,729 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz...
-2024-12-13 23:24:25,734 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:24:26,242 - INFO - Authentication (publickey) successful!
-2024-12-13 23:24:26,256 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:24:26,348 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:24:26,894 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:24:26,897 - INFO - parsing ../problem_instances/problem_instance.benzene.f377cc27-366a-45af-b45a-c8478e4b6199.json
-2024-12-13 23:24:26,903 - INFO - problem_instance UUID: f377cc27-366a-45af-b45a-c8478e4b6199
-2024-12-13 23:24:26,903 - INFO - problem_instance short name: benzene
-2024-12-13 23:24:26,903 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:24:26,915 - INFO - Analyzing task b86457a4-abf4-43c9-9c08-2397e95b7c0f...
-2024-12-13 23:24:26,915 - INFO - number of supporting files: 1
-2024-12-13 23:24:26,915 - INFO - supporting data file UUID: 4c655f65-1899-469c-975a-a3caec750697.
-2024-12-13 23:24:26,916 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz.
-2024-12-13 23:24:26,916 - INFO - assuming FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz is an FCIDUMP file.
-2024-12-13 23:24:26,916 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz...
-2024-12-13 23:24:26,920 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:24:27,426 - INFO - Authentication (publickey) successful!
-2024-12-13 23:24:27,441 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:24:27,512 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:24:27,617 - INFO - ===============================================
-2024-12-13 23:24:27,618 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:25:58,148 - INFO - Circuit initialization time: 90.530873 seconds.
-2024-12-13 23:25:58,149 - INFO - Estimating logical resources...
-2024-12-13 23:26:17,129 - INFO - Resource estimation time (seconds): 18.980482
-2024-12-13 23:26:17,129 - INFO - Analyzing task 7148b36a-0571-4a41-9239-19a97339f68a...
-2024-12-13 23:26:17,130 - INFO - number of supporting files: 1
-2024-12-13 23:26:17,130 - INFO - supporting data file UUID: 96ff0e22-a3ab-49f3-aee9-9a1886cbf850.
-2024-12-13 23:26:17,130 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz.
-2024-12-13 23:26:17,130 - INFO - assuming FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz is an FCIDUMP file.
-2024-12-13 23:26:17,130 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz...
-2024-12-13 23:26:17,135 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:26:17,662 - INFO - Authentication (publickey) successful!
-2024-12-13 23:26:17,676 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:26:41,734 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:27:02,621 - INFO - Skipping Logical Resource Estimate because number of orbitals (108) exceeds maximum specified in config (32).
-2024-12-13 23:27:02,631 - INFO - parsing ../problem_instances/problem_instance.Cr_1.02a8c4e9-9d15-4742-b4cc-7f47f69da0e5.json
-2024-12-13 23:27:02,631 - INFO - problem_instance UUID: 02a8c4e9-9d15-4742-b4cc-7f47f69da0e5
-2024-12-13 23:27:02,632 - INFO - problem_instance short name: Cr_1
-2024-12-13 23:27:02,632 - INFO - contains 3 associated Hamiltonians.
-2024-12-13 23:27:02,644 - INFO - Analyzing task b24b71b9-971a-4aca-9fc0-7198d16ca9ed...
-2024-12-13 23:27:02,644 - INFO - number of supporting files: 2
-2024-12-13 23:27:02,644 - INFO - supporting data file UUID: 69a1826c-1bee-4855-8f5f-5df29035bfca.
-2024-12-13 23:27:02,644 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz.
-2024-12-13 23:27:02,644 - INFO - assuming fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz is an FCIDUMP file.
-2024-12-13 23:27:02,644 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz...
-2024-12-13 23:27:02,649 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:27:03,184 - INFO - Authentication (publickey) successful!
-2024-12-13 23:27:03,200 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:27:03,497 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:27:05,226 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-13 23:27:05,226 - INFO - supporting data file UUID: 4ead3f70-392f-45e8-aa0d-f5e364d389d7.
-2024-12-13 23:27:05,226 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vdz.4ead3f70-392f-45e8-aa0d-f5e364d389d7.chk.
-2024-12-13 23:27:05,227 - INFO - assuming Cr1_vdz.4ead3f70-392f-45e8-aa0d-f5e364d389d7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:27:05,227 - INFO - Analyzing task e604a906-55fa-4b3f-bf17-c24a30312b84...
-2024-12-13 23:27:05,227 - INFO - number of supporting files: 2
-2024-12-13 23:27:05,227 - INFO - supporting data file UUID: 4e3649dd-9050-4acc-93f6-a09c962e89d7.
-2024-12-13 23:27:05,227 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz.
-2024-12-13 23:27:05,227 - INFO - assuming fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz is an FCIDUMP file.
-2024-12-13 23:27:05,227 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz...
-2024-12-13 23:27:05,232 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:27:05,739 - INFO - Authentication (publickey) successful!
-2024-12-13 23:27:05,753 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:31:58,507 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:33:19,235 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-13 23:33:19,235 - INFO - supporting data file UUID: ad74c129-2df4-4066-8972-6c0105bc0fa7.
-2024-12-13 23:33:19,235 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vqz.ad74c129-2df4-4066-8972-6c0105bc0fa7.chk.
-2024-12-13 23:33:19,235 - INFO - assuming Cr1_vqz.ad74c129-2df4-4066-8972-6c0105bc0fa7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:33:19,235 - INFO - Analyzing task f4b120e9-acd0-4c7c-89e2-cc082f52f5cf...
-2024-12-13 23:33:19,235 - INFO - number of supporting files: 2
-2024-12-13 23:33:19,235 - INFO - supporting data file UUID: efaceb68-6fae-491a-bb90-1e3e3463f010.
-2024-12-13 23:33:19,235 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz.
-2024-12-13 23:33:19,235 - INFO - assuming fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz is an FCIDUMP file.
-2024-12-13 23:33:19,235 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz...
-2024-12-13 23:33:19,240 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:33:19,778 - INFO - Authentication (publickey) successful!
-2024-12-13 23:33:19,792 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:33:29,846 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:33:42,044 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-13 23:33:42,044 - INFO - supporting data file UUID: 94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.
-2024-12-13 23:33:42,044 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vtz.94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.chk.
-2024-12-13 23:33:42,044 - INFO - assuming Cr1_vtz.94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:33:42,049 - INFO - parsing ../problem_instances/problem_instance.Ti_1.9823b0dd-87b6-4793-9741-e8cbcf2b50c0.json
-2024-12-13 23:33:42,049 - INFO - problem_instance UUID: 9823b0dd-87b6-4793-9741-e8cbcf2b50c0
-2024-12-13 23:33:42,049 - INFO - problem_instance short name: Ti_1
-2024-12-13 23:33:42,049 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:33:42,062 - INFO - Analyzing task 2cd76a23-0514-458a-b588-94e2d10564d3...
-2024-12-13 23:33:42,063 - INFO - number of supporting files: 2
-2024-12-13 23:33:42,063 - INFO - supporting data file UUID: 760e312c-9982-486d-b50e-d9acb003aedc.
-2024-12-13 23:33:42,063 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz.
-2024-12-13 23:33:42,063 - INFO - assuming fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz is an FCIDUMP file.
-2024-12-13 23:33:42,063 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz...
-2024-12-13 23:33:42,067 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:33:42,591 - INFO - Authentication (publickey) successful!
-2024-12-13 23:33:42,606 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:33:43,446 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:33:46,388 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-13 23:33:46,389 - INFO - supporting data file UUID: c4414ea6-320e-4c98-89ef-cc16d7932fd7.
-2024-12-13 23:33:46,389 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti1_vdz.c4414ea6-320e-4c98-89ef-cc16d7932fd7.chk.
-2024-12-13 23:33:46,389 - INFO - assuming Ti1_vdz.c4414ea6-320e-4c98-89ef-cc16d7932fd7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:33:46,389 - INFO - Analyzing task c7049602-5460-4277-8148-d9c66012f8f0...
-2024-12-13 23:33:46,389 - INFO - number of supporting files: 2
-2024-12-13 23:33:46,389 - INFO - supporting data file UUID: 2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.
-2024-12-13 23:33:46,389 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz.
-2024-12-13 23:33:46,389 - INFO - assuming fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz is an FCIDUMP file.
-2024-12-13 23:33:46,389 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz...
-2024-12-13 23:33:46,393 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:33:46,945 - INFO - Authentication (publickey) successful!
-2024-12-13 23:33:46,967 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:34:07,739 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:34:31,943 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-13 23:34:31,943 - INFO - supporting data file UUID: 1391b3e4-1862-4808-8990-dab576dade6a.
-2024-12-13 23:34:31,943 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti1_vtz.1391b3e4-1862-4808-8990-dab576dade6a.chk.
-2024-12-13 23:34:31,943 - INFO - assuming Ti1_vtz.1391b3e4-1862-4808-8990-dab576dade6a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:34:31,950 - INFO - parsing ../problem_instances/problem_instance.V_0.a14a1e28-71c5-4e23-bf6e-dd9662a6df58.json
-2024-12-13 23:34:31,951 - INFO - problem_instance UUID: a14a1e28-71c5-4e23-bf6e-dd9662a6df58
-2024-12-13 23:34:31,951 - INFO - problem_instance short name: V_0
-2024-12-13 23:34:31,951 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:34:31,967 - INFO - Analyzing task 0f0c8766-4bf5-4c1e-991a-9dafe9bc8f27...
-2024-12-13 23:34:31,967 - INFO - number of supporting files: 2
-2024-12-13 23:34:31,968 - INFO - supporting data file UUID: 950e31e2-142f-480b-b0d1-174381bdb64a.
-2024-12-13 23:34:31,968 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz.
-2024-12-13 23:34:31,968 - INFO - assuming fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz is an FCIDUMP file.
-2024-12-13 23:34:31,968 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz...
-2024-12-13 23:34:31,972 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:34:32,640 - INFO - Authentication (publickey) successful!
-2024-12-13 23:34:32,659 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:34:33,531 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:34:37,113 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-13 23:34:37,113 - INFO - supporting data file UUID: 5b236de2-1bb4-442b-8519-0af6e44d857d.
-2024-12-13 23:34:37,113 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V0_vdz.5b236de2-1bb4-442b-8519-0af6e44d857d.chk.
-2024-12-13 23:34:37,113 - INFO - assuming V0_vdz.5b236de2-1bb4-442b-8519-0af6e44d857d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:34:37,113 - INFO - Analyzing task 338f4b6e-775c-413b-a508-9132659ebbc3...
-2024-12-13 23:34:37,113 - INFO - number of supporting files: 2
-2024-12-13 23:34:37,113 - INFO - supporting data file UUID: d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.
-2024-12-13 23:34:37,113 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz.
-2024-12-13 23:34:37,114 - INFO - assuming fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz is an FCIDUMP file.
-2024-12-13 23:34:37,114 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz...
-2024-12-13 23:34:37,119 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:34:37,642 - INFO - Authentication (publickey) successful!
-2024-12-13 23:34:37,660 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:35:18,249 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:35:49,542 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-13 23:35:49,543 - INFO - supporting data file UUID: 1c843e96-bab4-4f23-8a9e-df61638fb804.
-2024-12-13 23:35:49,543 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V0_vtz.1c843e96-bab4-4f23-8a9e-df61638fb804.chk.
-2024-12-13 23:35:49,543 - INFO - assuming V0_vtz.1c843e96-bab4-4f23-8a9e-df61638fb804.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:35:49,554 - INFO - parsing ../problem_instances/problem_instance.CuO_0.886ad5bf-d487-48c8-b08c-c9f82b84ed5d.json
-2024-12-13 23:35:49,555 - INFO - problem_instance UUID: 886ad5bf-d487-48c8-b08c-c9f82b84ed5d
-2024-12-13 23:35:49,555 - INFO - problem_instance short name: CuO_0
-2024-12-13 23:35:49,555 - INFO - contains 1 associated Hamiltonians.
-2024-12-13 23:35:49,575 - INFO - Analyzing task 37e1f17b-384d-423d-860b-c75b9dcff951...
-2024-12-13 23:35:49,575 - INFO - number of supporting files: 2
-2024-12-13 23:35:49,575 - INFO - supporting data file UUID: da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.
-2024-12-13 23:35:49,575 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz.
-2024-12-13 23:35:49,575 - INFO - assuming fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz is an FCIDUMP file.
-2024-12-13 23:35:49,575 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz...
-2024-12-13 23:35:49,583 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:35:50,232 - INFO - Authentication (publickey) successful!
-2024-12-13 23:35:50,253 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:35:59,968 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:36:11,667 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-13 23:36:11,667 - INFO - supporting data file UUID: c4e62caf-cab0-444f-88f2-ce58f87079f2.
-2024-12-13 23:36:11,667 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/CuO_vdz.c4e62caf-cab0-444f-88f2-ce58f87079f2.chk.
-2024-12-13 23:36:11,667 - INFO - assuming CuO_vdz.c4e62caf-cab0-444f-88f2-ce58f87079f2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:36:11,669 - INFO - parsing ../problem_instances/problem_instance.TiO_0.0b91f99e-8de5-415d-a78e-f80e45d621ca.json
-2024-12-13 23:36:11,669 - INFO - problem_instance UUID: 0b91f99e-8de5-415d-a78e-f80e45d621ca
-2024-12-13 23:36:11,669 - INFO - problem_instance short name: TiO_0
-2024-12-13 23:36:11,669 - INFO - contains 1 associated Hamiltonians.
-2024-12-13 23:36:11,681 - INFO - Analyzing task 84aa9e2d-18e6-4689-9274-28e89ef44080...
-2024-12-13 23:36:11,681 - INFO - number of supporting files: 2
-2024-12-13 23:36:11,681 - INFO - supporting data file UUID: 98719f34-8ba8-4557-a9fd-b28a84fe7dd1.
-2024-12-13 23:36:11,681 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz.
-2024-12-13 23:36:11,681 - INFO - assuming fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz is an FCIDUMP file.
-2024-12-13 23:36:11,681 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz...
-2024-12-13 23:36:11,688 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:36:12,200 - INFO - Authentication (publickey) successful!
-2024-12-13 23:36:12,215 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:36:20,251 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:36:34,248 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-13 23:36:34,248 - INFO - supporting data file UUID: bee1776c-8031-4f23-a403-4475699e873f.
-2024-12-13 23:36:34,248 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/TiO_vdz.bee1776c-8031-4f23-a403-4475699e873f.chk.
-2024-12-13 23:36:34,248 - INFO - assuming TiO_vdz.bee1776c-8031-4f23-a403-4475699e873f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:36:34,251 - INFO - parsing ../problem_instances/problem_instance.na2_0.edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76.json
-2024-12-13 23:36:34,251 - INFO - problem_instance UUID: edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76
-2024-12-13 23:36:34,251 - INFO - problem_instance short name: na2_0
-2024-12-13 23:36:34,251 - INFO - contains 3 associated Hamiltonians.
-2024-12-13 23:36:34,267 - INFO - Analyzing task 4fb7e994-8e7a-4acd-86d4-bb52db824cfc...
-2024-12-13 23:36:34,267 - INFO - number of supporting files: 2
-2024-12-13 23:36:34,267 - INFO - supporting data file UUID: 4ceb8edc-937e-4cb6-9e42-51b6760b2557.
-2024-12-13 23:36:34,267 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz.
-2024-12-13 23:36:34,268 - INFO - assuming fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz is an FCIDUMP file.
-2024-12-13 23:36:34,268 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz...
-2024-12-13 23:36:34,274 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:36:34,946 - INFO - Authentication (publickey) successful!
-2024-12-13 23:36:34,961 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:36:35,082 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:36:35,783 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:36:35,784 - INFO - supporting data file UUID: 2014a3d7-1779-4d85-810f-ab908557987f.
-2024-12-13 23:36:35,784 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVDZ.2014a3d7-1779-4d85-810f-ab908557987f.chk.
-2024-12-13 23:36:35,784 - INFO - assuming na2_cc-pVDZ.2014a3d7-1779-4d85-810f-ab908557987f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:36:35,784 - INFO - Analyzing task f96de7fe-5c88-4083-8c48-72bc094cccfd...
-2024-12-13 23:36:35,784 - INFO - number of supporting files: 2
-2024-12-13 23:36:35,784 - INFO - supporting data file UUID: 4d93ba0f-4ad6-4107-b495-9284d226e13d.
-2024-12-13 23:36:35,784 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz.
-2024-12-13 23:36:35,784 - INFO - assuming fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz is an FCIDUMP file.
-2024-12-13 23:36:35,784 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz...
-2024-12-13 23:36:35,789 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:36:36,406 - INFO - Authentication (publickey) successful!
-2024-12-13 23:36:36,421 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:38:39,847 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:39:35,605 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-13 23:39:35,605 - INFO - supporting data file UUID: 299611a7-6df9-4cdd-ada5-ae74e038f77c.
-2024-12-13 23:39:35,605 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVQZ.299611a7-6df9-4cdd-ada5-ae74e038f77c.chk.
-2024-12-13 23:39:35,606 - INFO - assuming na2_cc-pVQZ.299611a7-6df9-4cdd-ada5-ae74e038f77c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:39:35,606 - INFO - Analyzing task 620e9ff4-07bf-4767-9237-d39aa659b8e5...
-2024-12-13 23:39:35,606 - INFO - number of supporting files: 2
-2024-12-13 23:39:35,606 - INFO - supporting data file UUID: c288da42-cf53-4437-a310-24bf3e35e008.
-2024-12-13 23:39:35,606 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz.
-2024-12-13 23:39:35,606 - INFO - assuming fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz is an FCIDUMP file.
-2024-12-13 23:39:35,606 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz...
-2024-12-13 23:39:35,611 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:39:36,141 - INFO - Authentication (publickey) successful!
-2024-12-13 23:39:36,155 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:39:37,956 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:39:43,351 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-13 23:39:43,352 - INFO - supporting data file UUID: 74e99e36-315d-4e29-a4c9-2ae0b1c932d6.
-2024-12-13 23:39:43,352 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVTZ.74e99e36-315d-4e29-a4c9-2ae0b1c932d6.chk.
-2024-12-13 23:39:43,352 - INFO - assuming na2_cc-pVTZ.74e99e36-315d-4e29-a4c9-2ae0b1c932d6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:39:43,354 - INFO - parsing ../problem_instances/problem_instance.mn_mono.cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8.json
-2024-12-13 23:39:43,390 - INFO - problem_instance UUID: cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8
-2024-12-13 23:39:43,390 - INFO - problem_instance short name: mn_mono
-2024-12-13 23:39:43,390 - INFO - contains 8 associated Hamiltonians.
-2024-12-13 23:39:43,402 - INFO - Analyzing task de3ea361-c2d3-4ab6-add4-ccd43cea6aa8...
-2024-12-13 23:39:43,403 - INFO - number of supporting files: 1
-2024-12-13 23:39:43,403 - INFO - supporting data file UUID: 68af0b80-3d27-4aba-84f9-bcdd30a9255b.
-2024-12-13 23:39:43,403 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz.
-2024-12-13 23:39:43,403 - INFO - assuming fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz is an FCIDUMP file.
-2024-12-13 23:39:43,403 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz...
-2024-12-13 23:39:43,407 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:39:43,931 - INFO - Authentication (publickey) successful!
-2024-12-13 23:39:43,947 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:39:44,002 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:39:44,017 - INFO - ===============================================
-2024-12-13 23:39:44,017 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:39:53,709 - INFO - Circuit initialization time: 9.692099 seconds.
-2024-12-13 23:39:53,709 - INFO - Estimating logical resources...
-2024-12-13 23:39:56,340 - INFO - Resource estimation time (seconds): 2.631003
-2024-12-13 23:39:56,341 - INFO - Analyzing task 6c39d3a7-c71a-4049-a8c7-3a3a4b61d8da...
-2024-12-13 23:39:56,341 - INFO - number of supporting files: 1
-2024-12-13 23:39:56,341 - INFO - supporting data file UUID: 28a7820f-63fe-4920-aeec-a7ffe7e55d83.
-2024-12-13 23:39:56,341 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz.
-2024-12-13 23:39:56,341 - INFO - assuming fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz is an FCIDUMP file.
-2024-12-13 23:39:56,341 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz...
-2024-12-13 23:39:56,346 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:39:56,849 - INFO - Authentication (publickey) successful!
-2024-12-13 23:39:56,864 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:39:56,980 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:39:57,247 - INFO - ===============================================
-2024-12-13 23:39:57,248 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:43:11,632 - INFO - Circuit initialization time: 194.384515 seconds.
-2024-12-13 23:43:11,633 - INFO - Estimating logical resources...
-2024-12-13 23:43:38,329 - INFO - Resource estimation time (seconds): 26.696127
-2024-12-13 23:43:38,329 - INFO - Analyzing task 1ade03f3-06b1-4e95-b271-fea5a6343829...
-2024-12-13 23:43:38,329 - INFO - number of supporting files: 1
-2024-12-13 23:43:38,330 - INFO - supporting data file UUID: f738fcd6-7ddc-4d70-8ff9-4019e3718b04.
-2024-12-13 23:43:38,330 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz.
-2024-12-13 23:43:38,330 - INFO - assuming fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz is an FCIDUMP file.
-2024-12-13 23:43:38,330 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz...
-2024-12-13 23:43:38,335 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:43:38,851 - INFO - Authentication (publickey) successful!
-2024-12-13 23:43:38,864 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:43:38,917 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:43:38,934 - INFO - ===============================================
-2024-12-13 23:43:38,934 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:43:48,530 - INFO - Circuit initialization time: 9.596358 seconds.
-2024-12-13 23:43:48,531 - INFO - Estimating logical resources...
-2024-12-13 23:43:51,331 - INFO - Resource estimation time (seconds): 2.800315
-2024-12-13 23:43:51,332 - INFO - Analyzing task ff0da1e2-2c76-4589-aefa-c13bb1a1ef8f...
-2024-12-13 23:43:51,332 - INFO - number of supporting files: 1
-2024-12-13 23:43:51,332 - INFO - supporting data file UUID: 6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.
-2024-12-13 23:43:51,332 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz.
-2024-12-13 23:43:51,332 - INFO - assuming fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz is an FCIDUMP file.
-2024-12-13 23:43:51,333 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz...
-2024-12-13 23:43:51,337 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:43:51,856 - INFO - Authentication (publickey) successful!
-2024-12-13 23:43:51,868 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:43:51,988 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:43:52,312 - INFO - ===============================================
-2024-12-13 23:43:52,312 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:47:35,196 - INFO - Circuit initialization time: 222.883763 seconds.
-2024-12-13 23:47:35,196 - INFO - Estimating logical resources...
-2024-12-13 23:48:05,199 - INFO - Resource estimation time (seconds): 30.002143
-2024-12-13 23:48:05,199 - INFO - Analyzing task a9c90f98-6557-44d2-9ca0-0c9122f4080c...
-2024-12-13 23:48:05,199 - INFO - number of supporting files: 1
-2024-12-13 23:48:05,199 - INFO - supporting data file UUID: 027490ba-34f9-4340-89ab-27fd110d2821.
-2024-12-13 23:48:05,200 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz.
-2024-12-13 23:48:05,200 - INFO - assuming fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz is an FCIDUMP file.
-2024-12-13 23:48:05,200 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz...
-2024-12-13 23:48:05,205 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:48:05,745 - INFO - Authentication (publickey) successful!
-2024-12-13 23:48:05,762 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:48:05,835 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:48:05,854 - INFO - ===============================================
-2024-12-13 23:48:05,855 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:48:15,682 - INFO - Circuit initialization time: 9.827025 seconds.
-2024-12-13 23:48:15,682 - INFO - Estimating logical resources...
-2024-12-13 23:48:18,391 - INFO - Resource estimation time (seconds): 2.709139
-2024-12-13 23:48:18,392 - INFO - Analyzing task a16168e2-98cd-430d-a180-84f64b4d5e75...
-2024-12-13 23:48:18,392 - INFO - number of supporting files: 1
-2024-12-13 23:48:18,392 - INFO - supporting data file UUID: bae2da57-6a69-483e-95bc-b77f72ebfba8.
-2024-12-13 23:48:18,392 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz.
-2024-12-13 23:48:18,392 - INFO - assuming fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz is an FCIDUMP file.
-2024-12-13 23:48:18,393 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz...
-2024-12-13 23:48:18,398 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:48:18,915 - INFO - Authentication (publickey) successful!
-2024-12-13 23:48:18,930 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:48:19,015 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:48:19,332 - INFO - ===============================================
-2024-12-13 23:48:19,332 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:52:05,551 - INFO - Circuit initialization time: 226.21892 seconds.
-2024-12-13 23:52:05,552 - INFO - Estimating logical resources...
-2024-12-13 23:52:36,135 - INFO - Resource estimation time (seconds): 30.583492
-2024-12-13 23:52:36,136 - INFO - Analyzing task 590c2f0b-964b-4d09-96ad-101a9be59cab...
-2024-12-13 23:52:36,136 - INFO - number of supporting files: 1
-2024-12-13 23:52:36,136 - INFO - supporting data file UUID: 72343006-774e-4192-b481-fa840ed25573.
-2024-12-13 23:52:36,137 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz.
-2024-12-13 23:52:36,137 - INFO - assuming fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz is an FCIDUMP file.
-2024-12-13 23:52:36,137 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz...
-2024-12-13 23:52:36,143 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:52:36,681 - INFO - Authentication (publickey) successful!
-2024-12-13 23:52:36,695 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:52:36,742 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:52:36,758 - INFO - ===============================================
-2024-12-13 23:52:36,758 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:52:46,697 - INFO - Circuit initialization time: 9.938555 seconds.
-2024-12-13 23:52:46,697 - INFO - Estimating logical resources...
-2024-12-13 23:52:49,520 - INFO - Resource estimation time (seconds): 2.823163
-2024-12-13 23:52:49,521 - INFO - Analyzing task 6e617348-d0b3-4b6d-9923-ea54ba5cf751...
-2024-12-13 23:52:49,521 - INFO - number of supporting files: 1
-2024-12-13 23:52:49,521 - INFO - supporting data file UUID: ea55abec-8253-445d-85fa-914948b5e5a5.
-2024-12-13 23:52:49,521 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz.
-2024-12-13 23:52:49,521 - INFO - assuming fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz is an FCIDUMP file.
-2024-12-13 23:52:49,521 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz...
-2024-12-13 23:52:49,525 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:52:50,063 - INFO - Authentication (publickey) successful!
-2024-12-13 23:52:50,075 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:52:50,154 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:52:50,479 - INFO - ===============================================
-2024-12-13 23:52:50,479 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:56:34,310 - INFO - Circuit initialization time: 223.83054 seconds.
-2024-12-13 23:56:34,310 - INFO - Estimating logical resources...
-2024-12-13 23:57:04,410 - INFO - Resource estimation time (seconds): 30.099989
-2024-12-13 23:57:04,412 - INFO - parsing ../problem_instances/problem_instance.FeO_0.55d0ed82-0560-4448-8459-c2ba00654d9d.json
-2024-12-13 23:57:04,412 - INFO - problem_instance UUID: 55d0ed82-0560-4448-8459-c2ba00654d9d
-2024-12-13 23:57:04,412 - INFO - problem_instance short name: FeO_0
-2024-12-13 23:57:04,412 - INFO - contains 1 associated Hamiltonians.
-2024-12-13 23:57:04,424 - INFO - Analyzing task b8344eb5-f574-4198-b917-8312240ba288...
-2024-12-13 23:57:04,424 - INFO - number of supporting files: 2
-2024-12-13 23:57:04,424 - INFO - supporting data file UUID: 3f1777dc-c493-4aa7-b3d1-6271d9bed459.
-2024-12-13 23:57:04,424 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz.
-2024-12-13 23:57:04,424 - INFO - assuming fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz is an FCIDUMP file.
-2024-12-13 23:57:04,424 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz...
-2024-12-13 23:57:04,429 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:57:04,950 - INFO - Authentication (publickey) successful!
-2024-12-13 23:57:04,963 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:57:13,813 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:57:26,978 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-13 23:57:26,978 - INFO - supporting data file UUID: 8bb3298d-0a60-4249-bfc5-94f399fbd522.
-2024-12-13 23:57:26,978 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/FeO_vdz.8bb3298d-0a60-4249-bfc5-94f399fbd522.chk.
-2024-12-13 23:57:26,978 - INFO - assuming FeO_vdz.8bb3298d-0a60-4249-bfc5-94f399fbd522.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:57:26,980 - INFO - parsing ../problem_instances/problem_instance.p_h3_0.0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57.json
-2024-12-13 23:57:26,980 - INFO - problem_instance UUID: 0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57
-2024-12-13 23:57:26,981 - INFO - problem_instance short name: p_h3_0
-2024-12-13 23:57:26,981 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:57:26,991 - INFO - Analyzing task af399f2b-a4f8-4fec-aca2-7c126ed989a5...
-2024-12-13 23:57:26,991 - INFO - number of supporting files: 2
-2024-12-13 23:57:26,991 - INFO - supporting data file UUID: 7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.
-2024-12-13 23:57:26,991 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz.
-2024-12-13 23:57:26,991 - INFO - assuming fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz is an FCIDUMP file.
-2024-12-13 23:57:26,991 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz...
-2024-12-13 23:57:26,998 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:57:27,664 - INFO - Authentication (publickey) successful!
-2024-12-13 23:57:27,681 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:57:27,829 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:57:28,843 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-13 23:57:28,844 - INFO - supporting data file UUID: e7dafb07-2975-4414-9924-2f8037778aee.
-2024-12-13 23:57:28,844 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p_h3_cc-pVDZ.e7dafb07-2975-4414-9924-2f8037778aee.chk.
-2024-12-13 23:57:28,844 - INFO - assuming p_h3_cc-pVDZ.e7dafb07-2975-4414-9924-2f8037778aee.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:57:28,844 - INFO - Analyzing task 819ff18a-5aad-46df-83ef-bd209e44936b...
-2024-12-13 23:57:28,844 - INFO - number of supporting files: 2
-2024-12-13 23:57:28,844 - INFO - supporting data file UUID: 2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.
-2024-12-13 23:57:28,845 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz.
-2024-12-13 23:57:28,845 - INFO - assuming fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz is an FCIDUMP file.
-2024-12-13 23:57:28,845 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz...
-2024-12-13 23:57:28,850 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:57:29,514 - INFO - Authentication (publickey) successful!
-2024-12-13 23:57:29,548 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:57:54,033 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:58:17,492 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-13 23:58:17,492 - INFO - supporting data file UUID: b8c794eb-a077-4227-9777-80462e7beefd.
-2024-12-13 23:58:17,492 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p_h3_cc-pVTZ.b8c794eb-a077-4227-9777-80462e7beefd.chk.
-2024-12-13 23:58:17,492 - INFO - assuming p_h3_cc-pVTZ.b8c794eb-a077-4227-9777-80462e7beefd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:58:17,495 - INFO - parsing ../problem_instances/problem_instance.h2_s_0.208f2e50-2b56-4e72-815a-cba5cec1264c.json
-2024-12-13 23:58:17,495 - INFO - problem_instance UUID: 208f2e50-2b56-4e72-815a-cba5cec1264c
-2024-12-13 23:58:17,495 - INFO - problem_instance short name: h2_s_0
-2024-12-13 23:58:17,495 - INFO - contains 3 associated Hamiltonians.
-2024-12-13 23:58:17,507 - INFO - Analyzing task f2f09d9f-8328-4d4a-ba91-089f9e56bf0d...
-2024-12-13 23:58:17,508 - INFO - number of supporting files: 2
-2024-12-13 23:58:17,508 - INFO - supporting data file UUID: 11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.
-2024-12-13 23:58:17,508 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz.
-2024-12-13 23:58:17,508 - INFO - assuming fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz is an FCIDUMP file.
-2024-12-13 23:58:17,508 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz...
-2024-12-13 23:58:17,514 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:58:18,031 - INFO - Authentication (publickey) successful!
-2024-12-13 23:58:18,045 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:58:18,173 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:58:18,373 - INFO - ===============================================
-2024-12-13 23:58:18,373 - INFO - Calculating Logical Resource Estimate...
-2024-12-13 23:59:31,585 - INFO - Circuit initialization time: 73.212291 seconds.
-2024-12-13 23:59:31,585 - INFO - Estimating logical resources...
-2024-12-13 23:59:45,317 - INFO - Resource estimation time (seconds): 13.731639
-2024-12-13 23:59:45,317 - INFO - supporting data file UUID: b28fc567-776a-49e9-b537-f885125f2e41.
-2024-12-13 23:59:45,317 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVDZ.b28fc567-776a-49e9-b537-f885125f2e41.chk.
-2024-12-13 23:59:45,317 - INFO - assuming h2_s_cc-pVDZ.b28fc567-776a-49e9-b537-f885125f2e41.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:59:45,317 - INFO - Analyzing task 3d5186f9-82b3-4de0-9bc1-242d7bdb678a...
-2024-12-13 23:59:45,318 - INFO - number of supporting files: 2
-2024-12-13 23:59:45,318 - INFO - supporting data file UUID: 57afbbf8-5819-4ee7-b540-95974b8a1a3f.
-2024-12-13 23:59:45,318 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz.
-2024-12-13 23:59:45,318 - INFO - assuming fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz is an FCIDUMP file.
-2024-12-13 23:59:45,318 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz...
-2024-12-13 23:59:45,322 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:59:45,829 - INFO - Authentication (publickey) successful!
-2024-12-13 23:59:45,846 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:02:26,963 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:03:19,208 - INFO - Skipping Logical Resource Estimate because number of orbitals (119) exceeds maximum specified in config (32).
-2024-12-14 00:03:19,208 - INFO - supporting data file UUID: 6474909a-c9c8-4e8b-be9c-71207ece21ea.
-2024-12-14 00:03:19,208 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVQZ.6474909a-c9c8-4e8b-be9c-71207ece21ea.chk.
-2024-12-14 00:03:19,208 - INFO - assuming h2_s_cc-pVQZ.6474909a-c9c8-4e8b-be9c-71207ece21ea.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:03:19,208 - INFO - Analyzing task ec0baf59-05f5-49df-b5e5-8f887d822a10...
-2024-12-14 00:03:19,208 - INFO - number of supporting files: 2
-2024-12-14 00:03:19,208 - INFO - supporting data file UUID: 83f0f242-e184-4581-a77a-f019731d8a6f.
-2024-12-14 00:03:19,209 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz.
-2024-12-14 00:03:19,209 - INFO - assuming fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz is an FCIDUMP file.
-2024-12-14 00:03:19,209 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz...
-2024-12-14 00:03:19,214 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:03:19,760 - INFO - Authentication (publickey) successful!
-2024-12-14 00:03:19,778 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:03:21,052 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:03:25,154 - INFO - Skipping Logical Resource Estimate because number of orbitals (62) exceeds maximum specified in config (32).
-2024-12-14 00:03:25,154 - INFO - supporting data file UUID: 2081f24a-d7ea-452a-b9bc-9901d06282d6.
-2024-12-14 00:03:25,154 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVTZ.2081f24a-d7ea-452a-b9bc-9901d06282d6.chk.
-2024-12-14 00:03:25,155 - INFO - assuming h2_s_cc-pVTZ.2081f24a-d7ea-452a-b9bc-9901d06282d6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:03:25,156 - INFO - parsing ../problem_instances/problem_instance.Sc_0.67f72316-2262-44fb-8c0a-e159e1cd0cf0.json
-2024-12-14 00:03:25,157 - INFO - problem_instance UUID: 67f72316-2262-44fb-8c0a-e159e1cd0cf0
-2024-12-14 00:03:25,157 - INFO - problem_instance short name: Sc_0
-2024-12-14 00:03:25,157 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:03:25,168 - INFO - Analyzing task fb87d637-aaab-4e8f-8898-4ecca8bd0fe0...
-2024-12-14 00:03:25,168 - INFO - number of supporting files: 2
-2024-12-14 00:03:25,168 - INFO - supporting data file UUID: 9da0b1fb-c6a5-4da5-b390-3920e3c26154.
-2024-12-14 00:03:25,168 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz.
-2024-12-14 00:03:25,168 - INFO - assuming fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz is an FCIDUMP file.
-2024-12-14 00:03:25,168 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz...
-2024-12-14 00:03:25,178 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:03:25,724 - INFO - Authentication (publickey) successful!
-2024-12-14 00:03:25,749 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:03:26,302 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:03:28,672 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 00:03:28,672 - INFO - supporting data file UUID: 11066a5f-4cab-41ed-9bcf-bc34a77d52c6.
-2024-12-14 00:03:28,672 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vdz.11066a5f-4cab-41ed-9bcf-bc34a77d52c6.chk.
-2024-12-14 00:03:28,672 - INFO - assuming Sc0_vdz.11066a5f-4cab-41ed-9bcf-bc34a77d52c6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:03:28,672 - INFO - Analyzing task 96c6a0d7-8a1e-4189-a934-833b80ade346...
-2024-12-14 00:03:28,672 - INFO - number of supporting files: 2
-2024-12-14 00:03:28,672 - INFO - supporting data file UUID: 85c6b46a-59fe-4506-89d3-e6faec2383e2.
-2024-12-14 00:03:28,672 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz.
-2024-12-14 00:03:28,672 - INFO - assuming fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz is an FCIDUMP file.
-2024-12-14 00:03:28,672 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz...
-2024-12-14 00:03:28,677 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:03:29,210 - INFO - Authentication (publickey) successful!
-2024-12-14 00:03:29,228 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:07:06,647 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:08:08,187 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-14 00:08:08,187 - INFO - supporting data file UUID: 814f1b4d-2820-4c3f-8367-05f604deee43.
-2024-12-14 00:08:08,187 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vqz.814f1b4d-2820-4c3f-8367-05f604deee43.chk.
-2024-12-14 00:08:08,187 - INFO - assuming Sc0_vqz.814f1b4d-2820-4c3f-8367-05f604deee43.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:08:08,187 - INFO - Analyzing task dc1da839-0ccc-434c-bf9c-a3874ffc3b1c...
-2024-12-14 00:08:08,187 - INFO - number of supporting files: 2
-2024-12-14 00:08:08,187 - INFO - supporting data file UUID: 83008296-5ec9-4af7-a03b-372025fad080.
-2024-12-14 00:08:08,187 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz.
-2024-12-14 00:08:08,187 - INFO - assuming fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz is an FCIDUMP file.
-2024-12-14 00:08:08,187 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz...
-2024-12-14 00:08:08,191 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:08:08,749 - INFO - Authentication (publickey) successful!
-2024-12-14 00:08:08,765 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:08:15,635 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:08:28,515 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:08:28,515 - INFO - supporting data file UUID: 0a3909ae-25ab-4fd7-8625-12a477404329.
-2024-12-14 00:08:28,515 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vtz.0a3909ae-25ab-4fd7-8625-12a477404329.chk.
-2024-12-14 00:08:28,515 - INFO - assuming Sc0_vtz.0a3909ae-25ab-4fd7-8625-12a477404329.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:08:28,527 - INFO - parsing ../problem_instances/problem_instance.na_cl_0.3f141f05-532b-478d-b38a-2ae07baadc88.json
-2024-12-14 00:08:28,527 - INFO - problem_instance UUID: 3f141f05-532b-478d-b38a-2ae07baadc88
-2024-12-14 00:08:28,527 - INFO - problem_instance short name: na_cl_0
-2024-12-14 00:08:28,527 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:08:28,556 - INFO - Analyzing task da831b60-89ce-4c01-96f9-c9f8a4512aab...
-2024-12-14 00:08:28,556 - INFO - number of supporting files: 2
-2024-12-14 00:08:28,557 - INFO - supporting data file UUID: cd31956d-bef5-4112-9959-510170644e72.
-2024-12-14 00:08:28,557 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz.
-2024-12-14 00:08:28,557 - INFO - assuming fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz is an FCIDUMP file.
-2024-12-14 00:08:28,557 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz...
-2024-12-14 00:08:28,562 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:08:29,244 - INFO - Authentication (publickey) successful!
-2024-12-14 00:08:29,261 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:08:29,347 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:08:30,027 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 00:08:30,027 - INFO - supporting data file UUID: 54f78447-2f62-48c7-a584-037808c4e08c.
-2024-12-14 00:08:30,027 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVDZ.54f78447-2f62-48c7-a584-037808c4e08c.chk.
-2024-12-14 00:08:30,027 - INFO - assuming na_cl_cc-pVDZ.54f78447-2f62-48c7-a584-037808c4e08c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:08:30,027 - INFO - Analyzing task a2f9649f-0f47-4a5d-a6a7-b0bebc848797...
-2024-12-14 00:08:30,028 - INFO - number of supporting files: 2
-2024-12-14 00:08:30,028 - INFO - supporting data file UUID: 677d97ee-5a46-4d49-82d6-ca3fc98a59a7.
-2024-12-14 00:08:30,028 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz.
-2024-12-14 00:08:30,028 - INFO - assuming fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz is an FCIDUMP file.
-2024-12-14 00:08:30,028 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz...
-2024-12-14 00:08:30,034 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:08:30,684 - INFO - Authentication (publickey) successful!
-2024-12-14 00:08:30,700 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:11:06,920 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:06,902 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 00:12:06,902 - INFO - supporting data file UUID: fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.
-2024-12-14 00:12:06,903 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVQZ.fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.chk.
-2024-12-14 00:12:06,903 - INFO - assuming na_cl_cc-pVQZ.fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:12:06,903 - INFO - Analyzing task 01ec60f7-d38a-4c33-a498-659a388e10ee...
-2024-12-14 00:12:06,903 - INFO - number of supporting files: 2
-2024-12-14 00:12:06,903 - INFO - supporting data file UUID: 444f3f27-904b-463f-b2f2-c92686c9637d.
-2024-12-14 00:12:06,903 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz.
-2024-12-14 00:12:06,903 - INFO - assuming fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz is an FCIDUMP file.
-2024-12-14 00:12:06,903 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz...
-2024-12-14 00:12:06,908 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:12:07,455 - INFO - Authentication (publickey) successful!
-2024-12-14 00:12:07,483 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:12:12,623 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:19,297 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 00:12:19,298 - INFO - supporting data file UUID: 0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.
-2024-12-14 00:12:19,298 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVTZ.0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.chk.
-2024-12-14 00:12:19,298 - INFO - assuming na_cl_cc-pVTZ.0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:12:19,300 - INFO - parsing ../problem_instances/problem_instance.c2_h2_0.0ca102a7-dad4-4d42-8c73-9acfa45378d7.json
-2024-12-14 00:12:19,300 - INFO - problem_instance UUID: 0ca102a7-dad4-4d42-8c73-9acfa45378d7
-2024-12-14 00:12:19,300 - INFO - problem_instance short name: c2_h2_0
-2024-12-14 00:12:19,300 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:12:19,314 - INFO - Analyzing task 2761e36e-f001-42af-8086-f507b5643ec8...
-2024-12-14 00:12:19,314 - INFO - number of supporting files: 2
-2024-12-14 00:12:19,314 - INFO - supporting data file UUID: 5b507b3d-b6fc-4e13-9586-06113819d99f.
-2024-12-14 00:12:19,314 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz.
-2024-12-14 00:12:19,314 - INFO - assuming fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz is an FCIDUMP file.
-2024-12-14 00:12:19,314 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz...
-2024-12-14 00:12:19,319 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:12:19,920 - INFO - Authentication (publickey) successful!
-2024-12-14 00:12:19,944 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:12:20,065 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:20,580 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 00:12:20,580 - INFO - supporting data file UUID: 7d37092e-ec2a-4cc0-b18a-211e358f2a3d.
-2024-12-14 00:12:20,580 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h2_cc-pVDZ.7d37092e-ec2a-4cc0-b18a-211e358f2a3d.chk.
-2024-12-14 00:12:20,580 - INFO - assuming c2_h2_cc-pVDZ.7d37092e-ec2a-4cc0-b18a-211e358f2a3d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:12:20,580 - INFO - Analyzing task b1352b0c-aa96-4f58-a0e2-356d3c43c8a1...
-2024-12-14 00:12:20,580 - INFO - number of supporting files: 2
-2024-12-14 00:12:20,580 - INFO - supporting data file UUID: 57793481-c847-4746-8241-ea949add5f87.
-2024-12-14 00:12:20,580 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz.
-2024-12-14 00:12:20,580 - INFO - assuming fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz is an FCIDUMP file.
-2024-12-14 00:12:20,580 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz...
-2024-12-14 00:12:20,585 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:12:21,142 - INFO - Authentication (publickey) successful!
-2024-12-14 00:12:21,157 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:12:30,743 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:46,027 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:12:46,028 - INFO - supporting data file UUID: f6d434e3-5c53-44f3-80ac-da5e7851f45a.
-2024-12-14 00:12:46,028 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h2_cc-pVTZ.f6d434e3-5c53-44f3-80ac-da5e7851f45a.chk.
-2024-12-14 00:12:46,028 - INFO - assuming c2_h2_cc-pVTZ.f6d434e3-5c53-44f3-80ac-da5e7851f45a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:12:46,040 - INFO - parsing ../problem_instances/problem_instance.li_f_0.e48e7467-1fcd-478b-a599-f4ce881c57b9.json
-2024-12-14 00:12:46,040 - INFO - problem_instance UUID: e48e7467-1fcd-478b-a599-f4ce881c57b9
-2024-12-14 00:12:46,040 - INFO - problem_instance short name: li_f_0
-2024-12-14 00:12:46,040 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:12:46,057 - INFO - Analyzing task 80043b93-039c-4d5a-abcb-84b8f25f7abb...
-2024-12-14 00:12:46,057 - INFO - number of supporting files: 2
-2024-12-14 00:12:46,057 - INFO - supporting data file UUID: 19cf5a4d-e90f-4ab1-a062-b20089724a63.
-2024-12-14 00:12:46,057 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz.
-2024-12-14 00:12:46,057 - INFO - assuming fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz is an FCIDUMP file.
-2024-12-14 00:12:46,057 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz...
-2024-12-14 00:12:46,068 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:12:46,698 - INFO - Authentication (publickey) successful!
-2024-12-14 00:12:46,712 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:12:46,802 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:47,015 - INFO - ===============================================
-2024-12-14 00:12:47,016 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:14:15,351 - INFO - Circuit initialization time: 88.335547 seconds.
-2024-12-14 00:14:15,352 - INFO - Estimating logical resources...
-2024-12-14 00:14:28,624 - INFO - Resource estimation time (seconds): 13.272102
-2024-12-14 00:14:28,624 - INFO - supporting data file UUID: e04452b6-2617-4dd7-a493-1d3e5e02639a.
-2024-12-14 00:14:28,624 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVDZ.e04452b6-2617-4dd7-a493-1d3e5e02639a.chk.
-2024-12-14 00:14:28,624 - INFO - assuming li_f_cc-pVDZ.e04452b6-2617-4dd7-a493-1d3e5e02639a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:14:28,624 - INFO - Analyzing task 0485949f-722c-49ee-a748-eec54801f021...
-2024-12-14 00:14:28,624 - INFO - number of supporting files: 2
-2024-12-14 00:14:28,624 - INFO - supporting data file UUID: 2294b211-7a05-445e-810d-4c1706e1444c.
-2024-12-14 00:14:28,624 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz.
-2024-12-14 00:14:28,624 - INFO - assuming fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz is an FCIDUMP file.
-2024-12-14 00:14:28,624 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz...
-2024-12-14 00:14:28,629 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:14:29,148 - INFO - Authentication (publickey) successful!
-2024-12-14 00:14:29,169 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:16:00,079 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:16:44,831 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 00:16:44,832 - INFO - supporting data file UUID: e2d31834-f73d-46a0-ba41-fa67b298611c.
-2024-12-14 00:16:44,832 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVQZ.e2d31834-f73d-46a0-ba41-fa67b298611c.chk.
-2024-12-14 00:16:44,832 - INFO - assuming li_f_cc-pVQZ.e2d31834-f73d-46a0-ba41-fa67b298611c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:16:44,832 - INFO - Analyzing task b80345ff-5df9-4fb3-86ab-0a25188b296d...
-2024-12-14 00:16:44,832 - INFO - number of supporting files: 2
-2024-12-14 00:16:44,832 - INFO - supporting data file UUID: c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.
-2024-12-14 00:16:44,832 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz.
-2024-12-14 00:16:44,832 - INFO - assuming fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz is an FCIDUMP file.
-2024-12-14 00:16:44,832 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz...
-2024-12-14 00:16:44,837 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:16:45,349 - INFO - Authentication (publickey) successful!
-2024-12-14 00:16:45,363 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:16:46,298 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:16:50,126 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 00:16:50,126 - INFO - supporting data file UUID: b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.
-2024-12-14 00:16:50,126 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVTZ.b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.chk.
-2024-12-14 00:16:50,126 - INFO - assuming li_f_cc-pVTZ.b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:16:50,129 - INFO - parsing ../problem_instances/problem_instance.h2_c_o_0.25fd617b-8e7f-4422-9e97-cc3f6b0d3876.json
-2024-12-14 00:16:50,130 - INFO - problem_instance UUID: 25fd617b-8e7f-4422-9e97-cc3f6b0d3876
-2024-12-14 00:16:50,130 - INFO - problem_instance short name: h2_c_o_0
-2024-12-14 00:16:50,130 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:16:50,141 - INFO - Analyzing task d58cb72b-e144-4164-aec0-309aaef6394c...
-2024-12-14 00:16:50,141 - INFO - number of supporting files: 2
-2024-12-14 00:16:50,142 - INFO - supporting data file UUID: d3d8851e-f3df-490c-975a-467933bd9fa1.
-2024-12-14 00:16:50,142 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz.
-2024-12-14 00:16:50,142 - INFO - assuming fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz is an FCIDUMP file.
-2024-12-14 00:16:50,142 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz...
-2024-12-14 00:16:50,149 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:16:50,722 - INFO - Authentication (publickey) successful!
-2024-12-14 00:16:50,741 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:16:50,848 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:16:51,371 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 00:16:51,371 - INFO - supporting data file UUID: 25a78420-0b29-4de5-acdc-104aa0f0b9fb.
-2024-12-14 00:16:51,371 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_c_o_cc-pVDZ.25a78420-0b29-4de5-acdc-104aa0f0b9fb.chk.
-2024-12-14 00:16:51,371 - INFO - assuming h2_c_o_cc-pVDZ.25a78420-0b29-4de5-acdc-104aa0f0b9fb.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:16:51,371 - INFO - Analyzing task ed09e1bf-40f3-4bf0-b9c7-7bb1990c5cae...
-2024-12-14 00:16:51,371 - INFO - number of supporting files: 2
-2024-12-14 00:16:51,371 - INFO - supporting data file UUID: f1c78add-0e23-423a-bb96-f1370626aa47.
-2024-12-14 00:16:51,371 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz.
-2024-12-14 00:16:51,371 - INFO - assuming fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz is an FCIDUMP file.
-2024-12-14 00:16:51,371 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz...
-2024-12-14 00:16:51,376 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:16:52,054 - INFO - Authentication (publickey) successful!
-2024-12-14 00:16:52,071 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:16:58,377 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:17:12,158 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:17:12,159 - INFO - supporting data file UUID: 30bd24e2-947b-4917-89bb-8bdb17406ff5.
-2024-12-14 00:17:12,159 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_c_o_cc-pVTZ.30bd24e2-947b-4917-89bb-8bdb17406ff5.chk.
-2024-12-14 00:17:12,159 - INFO - assuming h2_c_o_cc-pVTZ.30bd24e2-947b-4917-89bb-8bdb17406ff5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:17:12,167 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0011.766ba2da-e72a-4e03-a739-f97269026fc4.json
-2024-12-14 00:17:12,197 - INFO - problem_instance UUID: 766ba2da-e72a-4e03-a739-f97269026fc4
-2024-12-14 00:17:12,198 - INFO - problem_instance short name: planted_solution_0011
-2024-12-14 00:17:12,198 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:17:12,214 - INFO - Analyzing task 0021e256-8e13-42db-839d-e9155e8af82c...
-2024-12-14 00:17:12,214 - INFO - number of supporting files: 1
-2024-12-14 00:17:12,214 - INFO - supporting data file UUID: befcf6f0-cfcb-49b7-b661-de48ad8a44c8.
-2024-12-14 00:17:12,215 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz.
-2024-12-14 00:17:12,215 - INFO - assuming fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz is an FCIDUMP file.
-2024-12-14 00:17:12,215 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz...
-2024-12-14 00:17:12,220 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:17:12,877 - INFO - Authentication (publickey) successful!
-2024-12-14 00:17:12,895 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:17:13,006 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:17:13,368 - INFO - ===============================================
-2024-12-14 00:17:13,369 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:19:56,940 - INFO - Circuit initialization time: 163.571263 seconds.
-2024-12-14 00:19:56,940 - INFO - Estimating logical resources...
-2024-12-14 00:20:02,010 - INFO - Resource estimation time (seconds): 5.069303
-2024-12-14 00:20:02,012 - INFO - parsing ../problem_instances/problem_instance.Mn_0.bc202949-d76c-4962-b937-5c12b298b8b4.json
-2024-12-14 00:20:02,012 - INFO - problem_instance UUID: bc202949-d76c-4962-b937-5c12b298b8b4
-2024-12-14 00:20:02,012 - INFO - problem_instance short name: Mn_0
-2024-12-14 00:20:02,012 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:20:02,023 - INFO - Analyzing task 289f5dfe-e6d5-48a3-a6ae-25088321d3c6...
-2024-12-14 00:20:02,023 - INFO - number of supporting files: 2
-2024-12-14 00:20:02,023 - INFO - supporting data file UUID: a83413fb-96e3-466e-910b-6d4bab7cdf1d.
-2024-12-14 00:20:02,023 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz.
-2024-12-14 00:20:02,023 - INFO - assuming fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz is an FCIDUMP file.
-2024-12-14 00:20:02,023 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz...
-2024-12-14 00:20:02,029 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:20:02,548 - INFO - Authentication (publickey) successful!
-2024-12-14 00:20:02,561 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:20:03,698 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:20:07,762 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 00:20:07,762 - INFO - supporting data file UUID: da9344cd-a191-40aa-a0bd-726e7200facf.
-2024-12-14 00:20:07,762 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn0_vdz.da9344cd-a191-40aa-a0bd-726e7200facf.chk.
-2024-12-14 00:20:07,762 - INFO - assuming Mn0_vdz.da9344cd-a191-40aa-a0bd-726e7200facf.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:20:07,762 - INFO - Analyzing task 24f12fad-130e-44fc-8b07-bc26c5a3d878...
-2024-12-14 00:20:07,762 - INFO - number of supporting files: 2
-2024-12-14 00:20:07,762 - INFO - supporting data file UUID: 07c9da30-e172-4183-a8af-301628b75f1c.
-2024-12-14 00:20:07,762 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz.
-2024-12-14 00:20:07,762 - INFO - assuming fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz is an FCIDUMP file.
-2024-12-14 00:20:07,763 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz...
-2024-12-14 00:20:07,767 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:20:08,296 - INFO - Authentication (publickey) successful!
-2024-12-14 00:20:08,309 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:21:38,037 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:22:18,500 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:22:18,500 - INFO - supporting data file UUID: 2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.
-2024-12-14 00:22:18,500 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn0_vtz.2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.chk.
-2024-12-14 00:22:18,500 - INFO - assuming Mn0_vtz.2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:22:18,505 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0008.b57eb979-5c09-4974-97b4-5862e109a1ae.json
-2024-12-14 00:22:18,507 - INFO - problem_instance UUID: b57eb979-5c09-4974-97b4-5862e109a1ae
-2024-12-14 00:22:18,507 - INFO - problem_instance short name: planted_solution_0008
-2024-12-14 00:22:18,508 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:22:18,521 - INFO - Analyzing task af56de36-35aa-44b9-8eb7-b9c1e8f7d0f3...
-2024-12-14 00:22:18,522 - INFO - number of supporting files: 1
-2024-12-14 00:22:18,522 - INFO - supporting data file UUID: 44060124-8f2d-4a91-80a9-5a29f0f4f716.
-2024-12-14 00:22:18,522 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz.
-2024-12-14 00:22:18,522 - INFO - assuming fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz is an FCIDUMP file.
-2024-12-14 00:22:18,522 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz...
-2024-12-14 00:22:18,527 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:22:19,074 - INFO - Authentication (publickey) successful!
-2024-12-14 00:22:19,091 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:22:19,154 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:22:19,167 - INFO - ===============================================
-2024-12-14 00:22:19,168 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:22:26,902 - INFO - Circuit initialization time: 7.734096 seconds.
-2024-12-14 00:22:26,902 - INFO - Estimating logical resources...
-2024-12-14 00:22:28,213 - INFO - Resource estimation time (seconds): 1.310624
-2024-12-14 00:22:28,214 - INFO - parsing ../problem_instances/problem_instance.mo_n2.664ec8e4-09d5-41cc-6266-ddb26219366f.json
-2024-12-14 00:22:28,215 - INFO - problem_instance UUID: 664ec8e4-09d5-41cc-6266-ddb26219366f
-2024-12-14 00:22:28,215 - INFO - problem_instance short name: mo_n2
-2024-12-14 00:22:28,215 - INFO - contains 4 associated Hamiltonians.
-2024-12-14 00:22:28,226 - INFO - Analyzing task 00ba4917-d66a-4335-819f-43390dfc9929...
-2024-12-14 00:22:28,226 - INFO - number of supporting files: 1
-2024-12-14 00:22:28,226 - INFO - supporting data file UUID: 23aa47ca-9afe-4086-bd97-75de310e033e.
-2024-12-14 00:22:28,226 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz.
-2024-12-14 00:22:28,226 - INFO - assuming fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz is an FCIDUMP file.
-2024-12-14 00:22:28,226 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz...
-2024-12-14 00:22:28,231 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:22:28,744 - INFO - Authentication (publickey) successful!
-2024-12-14 00:22:28,758 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:22:28,837 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:22:29,143 - INFO - ===============================================
-2024-12-14 00:22:29,143 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:26:09,722 - INFO - Circuit initialization time: 220.578768 seconds.
-2024-12-14 00:26:09,722 - INFO - Estimating logical resources...
-2024-12-14 00:26:40,307 - INFO - Resource estimation time (seconds): 30.584804
-2024-12-14 00:26:40,307 - INFO - Analyzing task b9cc699a-80f8-4280-9731-23dee4d5a6a5...
-2024-12-14 00:26:40,307 - INFO - number of supporting files: 1
-2024-12-14 00:26:40,308 - INFO - supporting data file UUID: e10bd99a-435c-41cd-84f1-41bd67890fc7.
-2024-12-14 00:26:40,308 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz.
-2024-12-14 00:26:40,308 - INFO - assuming fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz is an FCIDUMP file.
-2024-12-14 00:26:40,308 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz...
-2024-12-14 00:26:40,317 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:26:40,841 - INFO - Authentication (publickey) successful!
-2024-12-14 00:26:40,856 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:26:41,146 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:26:42,653 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 00:26:42,653 - INFO - Analyzing task dfd78a05-437d-4667-88d7-7e2a3384b816...
-2024-12-14 00:26:42,653 - INFO - number of supporting files: 1
-2024-12-14 00:26:42,653 - INFO - supporting data file UUID: b71baf3c-d5f0-4f8d-aead-648ba69a058e.
-2024-12-14 00:26:42,653 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz.
-2024-12-14 00:26:42,654 - INFO - assuming fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz is an FCIDUMP file.
-2024-12-14 00:26:42,654 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz...
-2024-12-14 00:26:42,659 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:26:43,168 - INFO - Authentication (publickey) successful!
-2024-12-14 00:26:43,184 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:26:43,422 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:26:44,932 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 00:26:44,932 - INFO - Analyzing task 35c1aee4-4ef3-4e18-bc2a-377cf45e8fa1...
-2024-12-14 00:26:44,932 - INFO - number of supporting files: 1
-2024-12-14 00:26:44,932 - INFO - supporting data file UUID: 77c12db8-c32e-4f88-8552-9762a0fff763.
-2024-12-14 00:26:44,932 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz.
-2024-12-14 00:26:44,932 - INFO - assuming fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz is an FCIDUMP file.
-2024-12-14 00:26:44,932 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz...
-2024-12-14 00:26:44,937 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:26:45,457 - INFO - Authentication (publickey) successful!
-2024-12-14 00:26:45,470 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:26:45,569 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:26:45,900 - INFO - ===============================================
-2024-12-14 00:26:45,900 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:30:00,684 - INFO - Circuit initialization time: 194.784019 seconds.
-2024-12-14 00:30:00,684 - INFO - Estimating logical resources...
-2024-12-14 00:30:30,667 - INFO - Resource estimation time (seconds): 29.982253
-2024-12-14 00:30:30,668 - INFO - parsing ../problem_instances/problem_instance.li_h_0.6d355019-13aa-41fc-a530-31d5f968ba22.json
-2024-12-14 00:30:30,669 - INFO - problem_instance UUID: 6d355019-13aa-41fc-a530-31d5f968ba22
-2024-12-14 00:30:30,669 - INFO - problem_instance short name: li_h_0
-2024-12-14 00:30:30,669 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:30:30,681 - INFO - Analyzing task 92917287-d937-410c-bb70-c1f34224fab7...
-2024-12-14 00:30:30,681 - INFO - number of supporting files: 2
-2024-12-14 00:30:30,681 - INFO - supporting data file UUID: 9c6f0876-5690-4391-a98c-0347d111257e.
-2024-12-14 00:30:30,681 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz.
-2024-12-14 00:30:30,681 - INFO - assuming fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz is an FCIDUMP file.
-2024-12-14 00:30:30,681 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz...
-2024-12-14 00:30:30,686 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:30:31,216 - INFO - Authentication (publickey) successful!
-2024-12-14 00:30:31,232 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:30:31,296 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:30:31,334 - INFO - ===============================================
-2024-12-14 00:30:31,334 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:30:51,765 - INFO - Circuit initialization time: 20.430973 seconds.
-2024-12-14 00:30:51,765 - INFO - Estimating logical resources...
-2024-12-14 00:30:56,328 - INFO - Resource estimation time (seconds): 4.562898
-2024-12-14 00:30:56,329 - INFO - supporting data file UUID: 0be93350-ebd5-4fd0-bbbe-029a7cc7681b.
-2024-12-14 00:30:56,329 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVDZ.0be93350-ebd5-4fd0-bbbe-029a7cc7681b.chk.
-2024-12-14 00:30:56,329 - INFO - assuming li_h_cc-pVDZ.0be93350-ebd5-4fd0-bbbe-029a7cc7681b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:30:56,329 - INFO - Analyzing task 13b4bdcc-1cef-419a-92b1-156febff71d4...
-2024-12-14 00:30:56,329 - INFO - number of supporting files: 2
-2024-12-14 00:30:56,329 - INFO - supporting data file UUID: c21d87dd-9338-4498-8ed6-95b0dacd75b1.
-2024-12-14 00:30:56,329 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz.
-2024-12-14 00:30:56,329 - INFO - assuming fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz is an FCIDUMP file.
-2024-12-14 00:30:56,329 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz...
-2024-12-14 00:30:56,338 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:30:56,894 - INFO - Authentication (publickey) successful!
-2024-12-14 00:30:56,912 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:31:07,650 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:31:23,045 - INFO - Skipping Logical Resource Estimate because number of orbitals (85) exceeds maximum specified in config (32).
-2024-12-14 00:31:23,046 - INFO - supporting data file UUID: 10693a03-698b-416a-80c0-dd563193c1d4.
-2024-12-14 00:31:23,046 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVQZ.10693a03-698b-416a-80c0-dd563193c1d4.chk.
-2024-12-14 00:31:23,046 - INFO - assuming li_h_cc-pVQZ.10693a03-698b-416a-80c0-dd563193c1d4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:31:23,046 - INFO - Analyzing task d15db194-aa2d-4de9-8f86-fcffeb82f38b...
-2024-12-14 00:31:23,046 - INFO - number of supporting files: 2
-2024-12-14 00:31:23,046 - INFO - supporting data file UUID: 02d12f52-ff42-4adf-99b9-acada93cb96b.
-2024-12-14 00:31:23,047 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz.
-2024-12-14 00:31:23,047 - INFO - assuming fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz is an FCIDUMP file.
-2024-12-14 00:31:23,047 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz...
-2024-12-14 00:31:23,052 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:31:23,692 - INFO - Authentication (publickey) successful!
-2024-12-14 00:31:23,709 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:31:23,882 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:31:25,230 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 00:31:25,230 - INFO - supporting data file UUID: 17337d1b-d2a5-4121-bf4a-d7236edd5c05.
-2024-12-14 00:31:25,230 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVTZ.17337d1b-d2a5-4121-bf4a-d7236edd5c05.chk.
-2024-12-14 00:31:25,230 - INFO - assuming li_h_cc-pVTZ.17337d1b-d2a5-4121-bf4a-d7236edd5c05.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:31:25,233 - INFO - parsing ../problem_instances/problem_instance.li2_0.3301a356-21a9-472b-8021-f02f4d2c9eec.json
-2024-12-14 00:31:25,234 - INFO - problem_instance UUID: 3301a356-21a9-472b-8021-f02f4d2c9eec
-2024-12-14 00:31:25,234 - INFO - problem_instance short name: li2_0
-2024-12-14 00:31:25,234 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:31:25,251 - INFO - Analyzing task e7d3b8bd-ff6c-44f6-8a9e-b9b75396cee0...
-2024-12-14 00:31:25,251 - INFO - number of supporting files: 2
-2024-12-14 00:31:25,251 - INFO - supporting data file UUID: 243670ee-2d2e-4d90-abc1-16938a04a80b.
-2024-12-14 00:31:25,252 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz.
-2024-12-14 00:31:25,252 - INFO - assuming fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz is an FCIDUMP file.
-2024-12-14 00:31:25,252 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz...
-2024-12-14 00:31:25,258 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:31:25,902 - INFO - Authentication (publickey) successful!
-2024-12-14 00:31:25,920 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:31:26,007 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:31:26,154 - INFO - ===============================================
-2024-12-14 00:31:26,155 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:32:54,234 - INFO - Circuit initialization time: 88.079165 seconds.
-2024-12-14 00:32:54,234 - INFO - Estimating logical resources...
-2024-12-14 00:33:09,745 - INFO - Resource estimation time (seconds): 15.510731
-2024-12-14 00:33:09,746 - INFO - supporting data file UUID: 948cb44e-e229-4be7-ba48-8ee73e042a6a.
-2024-12-14 00:33:09,746 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVDZ.948cb44e-e229-4be7-ba48-8ee73e042a6a.chk.
-2024-12-14 00:33:09,746 - INFO - assuming li2_cc-pVDZ.948cb44e-e229-4be7-ba48-8ee73e042a6a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:33:09,746 - INFO - Analyzing task aaa24a30-ade6-44a6-b6aa-51bf54c31eef...
-2024-12-14 00:33:09,746 - INFO - number of supporting files: 2
-2024-12-14 00:33:09,746 - INFO - supporting data file UUID: 6224abe8-831e-4b52-b8d9-8ebac0a35c2b.
-2024-12-14 00:33:09,746 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz.
-2024-12-14 00:33:09,746 - INFO - assuming fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz is an FCIDUMP file.
-2024-12-14 00:33:09,746 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz...
-2024-12-14 00:33:09,751 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:33:10,387 - INFO - Authentication (publickey) successful!
-2024-12-14 00:33:10,402 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:33:38,412 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:34:07,638 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 00:34:07,638 - INFO - supporting data file UUID: 2c2461b8-9343-4405-a3d5-aadd0a6cdac9.
-2024-12-14 00:34:07,638 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVQZ.2c2461b8-9343-4405-a3d5-aadd0a6cdac9.chk.
-2024-12-14 00:34:07,639 - INFO - assuming li2_cc-pVQZ.2c2461b8-9343-4405-a3d5-aadd0a6cdac9.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:34:07,639 - INFO - Analyzing task 410cd417-988a-4f7f-99ad-93dda7eacdcb...
-2024-12-14 00:34:07,639 - INFO - number of supporting files: 2
-2024-12-14 00:34:07,639 - INFO - supporting data file UUID: 26d2547c-96a4-400d-9528-9987ae6699b2.
-2024-12-14 00:34:07,639 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz.
-2024-12-14 00:34:07,639 - INFO - assuming fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz is an FCIDUMP file.
-2024-12-14 00:34:07,639 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz...
-2024-12-14 00:34:07,645 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:34:08,294 - INFO - Authentication (publickey) successful!
-2024-12-14 00:34:08,311 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:34:08,775 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:34:11,522 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 00:34:11,522 - INFO - supporting data file UUID: e51ca409-0d43-4958-b89d-b0a3906c91d5.
-2024-12-14 00:34:11,522 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVTZ.e51ca409-0d43-4958-b89d-b0a3906c91d5.chk.
-2024-12-14 00:34:11,523 - INFO - assuming li2_cc-pVTZ.e51ca409-0d43-4958-b89d-b0a3906c91d5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:34:11,526 - INFO - parsing ../problem_instances/problem_instance.h_f_0.892e3341-7186-44c6-9a1a-20f270ddc8b8.json
-2024-12-14 00:34:11,526 - INFO - problem_instance UUID: 892e3341-7186-44c6-9a1a-20f270ddc8b8
-2024-12-14 00:34:11,526 - INFO - problem_instance short name: h_f_0
-2024-12-14 00:34:11,526 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:34:11,541 - INFO - Analyzing task b59bd259-4941-4cec-bca5-e2795c35d8e0...
-2024-12-14 00:34:11,541 - INFO - number of supporting files: 2
-2024-12-14 00:34:11,541 - INFO - supporting data file UUID: b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.
-2024-12-14 00:34:11,541 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz.
-2024-12-14 00:34:11,541 - INFO - assuming fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz is an FCIDUMP file.
-2024-12-14 00:34:11,541 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz...
-2024-12-14 00:34:11,546 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:34:12,198 - INFO - Authentication (publickey) successful!
-2024-12-14 00:34:12,215 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:34:12,280 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:34:12,330 - INFO - ===============================================
-2024-12-14 00:34:12,330 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:34:35,094 - INFO - Circuit initialization time: 22.76317 seconds.
-2024-12-14 00:34:35,094 - INFO - Estimating logical resources...
-2024-12-14 00:34:40,466 - INFO - Resource estimation time (seconds): 5.371073
-2024-12-14 00:34:40,466 - INFO - supporting data file UUID: 3bb657ac-2131-4ee7-9859-9e4ff876245a.
-2024-12-14 00:34:40,466 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVDZ.3bb657ac-2131-4ee7-9859-9e4ff876245a.chk.
-2024-12-14 00:34:40,467 - INFO - assuming h_f_cc-pVDZ.3bb657ac-2131-4ee7-9859-9e4ff876245a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:34:40,467 - INFO - Analyzing task 9e3c577f-a25d-42f5-a809-61dfb63a52de...
-2024-12-14 00:34:40,467 - INFO - number of supporting files: 2
-2024-12-14 00:34:40,467 - INFO - supporting data file UUID: ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.
-2024-12-14 00:34:40,467 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz.
-2024-12-14 00:34:40,468 - INFO - assuming fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz is an FCIDUMP file.
-2024-12-14 00:34:40,468 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz...
-2024-12-14 00:34:40,473 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:34:41,102 - INFO - Authentication (publickey) successful!
-2024-12-14 00:34:41,116 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:34:52,499 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:35:10,331 - INFO - Skipping Logical Resource Estimate because number of orbitals (85) exceeds maximum specified in config (32).
-2024-12-14 00:35:10,331 - INFO - supporting data file UUID: ddc246a3-9770-4542-8cfd-74afbff4e7a0.
-2024-12-14 00:35:10,331 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVQZ.ddc246a3-9770-4542-8cfd-74afbff4e7a0.chk.
-2024-12-14 00:35:10,331 - INFO - assuming h_f_cc-pVQZ.ddc246a3-9770-4542-8cfd-74afbff4e7a0.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:35:10,331 - INFO - Analyzing task daa86ad6-bda9-4d47-a50d-4ec34801bd82...
-2024-12-14 00:35:10,331 - INFO - number of supporting files: 2
-2024-12-14 00:35:10,331 - INFO - supporting data file UUID: 819ffa8e-51ee-4e78-aa07-17686d7a9488.
-2024-12-14 00:35:10,331 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz.
-2024-12-14 00:35:10,332 - INFO - assuming fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz is an FCIDUMP file.
-2024-12-14 00:35:10,332 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz...
-2024-12-14 00:35:10,337 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:35:10,999 - INFO - Authentication (publickey) successful!
-2024-12-14 00:35:11,014 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:35:11,194 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:35:12,689 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 00:35:12,689 - INFO - supporting data file UUID: 7369a736-b751-4ace-a057-7f6a07194ffa.
-2024-12-14 00:35:12,690 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVTZ.7369a736-b751-4ace-a057-7f6a07194ffa.chk.
-2024-12-14 00:35:12,690 - INFO - assuming h_f_cc-pVTZ.7369a736-b751-4ace-a057-7f6a07194ffa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:35:12,692 - INFO - parsing ../problem_instances/problem_instance.Fe_0.05abb33d-ecea-406f-8832-31a814b26dfd.json
-2024-12-14 00:35:12,692 - INFO - problem_instance UUID: 05abb33d-ecea-406f-8832-31a814b26dfd
-2024-12-14 00:35:12,693 - INFO - problem_instance short name: Fe_0
-2024-12-14 00:35:12,693 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:35:12,708 - INFO - Analyzing task 5b8f4746-a08b-4ec5-92e2-ce55cc2fdb75...
-2024-12-14 00:35:12,708 - INFO - number of supporting files: 2
-2024-12-14 00:35:12,708 - INFO - supporting data file UUID: 133ec573-3d06-4582-b2f5-8afe8be8dbe3.
-2024-12-14 00:35:12,708 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz.
-2024-12-14 00:35:12,709 - INFO - assuming fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz is an FCIDUMP file.
-2024-12-14 00:35:12,709 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz...
-2024-12-14 00:35:12,715 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:35:13,364 - INFO - Authentication (publickey) successful!
-2024-12-14 00:35:13,386 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:35:15,474 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:35:22,727 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 00:35:22,727 - INFO - supporting data file UUID: 6644ed13-743e-4f98-8ab9-6c2abf88d032.
-2024-12-14 00:35:22,727 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe0_vdz.6644ed13-743e-4f98-8ab9-6c2abf88d032.chk.
-2024-12-14 00:35:22,727 - INFO - assuming Fe0_vdz.6644ed13-743e-4f98-8ab9-6c2abf88d032.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:35:22,728 - INFO - Analyzing task c63f5f9b-ee73-4887-949b-dd1e74c31874...
-2024-12-14 00:35:22,728 - INFO - number of supporting files: 2
-2024-12-14 00:35:22,728 - INFO - supporting data file UUID: cb274492-6acb-4426-a4f6-8cb4a8cef3c5.
-2024-12-14 00:35:22,728 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz.
-2024-12-14 00:35:22,728 - INFO - assuming fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz is an FCIDUMP file.
-2024-12-14 00:35:22,728 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz...
-2024-12-14 00:35:22,735 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:35:23,361 - INFO - Authentication (publickey) successful!
-2024-12-14 00:35:23,378 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:36:55,164 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:37:45,799 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:37:45,799 - INFO - supporting data file UUID: 9d520d39-2e21-4294-8d58-af6d068b38de.
-2024-12-14 00:37:45,799 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe0_vtz.9d520d39-2e21-4294-8d58-af6d068b38de.chk.
-2024-12-14 00:37:45,799 - INFO - assuming Fe0_vtz.9d520d39-2e21-4294-8d58-af6d068b38de.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:37:45,811 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0010.bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8.json
-2024-12-14 00:37:45,842 - INFO - problem_instance UUID: bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8
-2024-12-14 00:37:45,843 - INFO - problem_instance short name: planted_solution_0010
-2024-12-14 00:37:45,843 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:37:45,867 - INFO - Analyzing task 7cc1ed5c-0dcb-4315-9e51-2ae94b5cdd02...
-2024-12-14 00:37:45,867 - INFO - number of supporting files: 1
-2024-12-14 00:37:45,867 - INFO - supporting data file UUID: eea867d0-285e-462d-94ab-15579c782be7.
-2024-12-14 00:37:45,867 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz.
-2024-12-14 00:37:45,867 - INFO - assuming fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz is an FCIDUMP file.
-2024-12-14 00:37:45,867 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz...
-2024-12-14 00:37:45,873 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:37:46,505 - INFO - Authentication (publickey) successful!
-2024-12-14 00:37:46,521 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:37:46,611 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:37:46,907 - INFO - ===============================================
-2024-12-14 00:37:46,907 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:40:39,359 - INFO - Circuit initialization time: 172.451545 seconds.
-2024-12-14 00:40:39,359 - INFO - Estimating logical resources...
-2024-12-14 00:40:45,445 - INFO - Resource estimation time (seconds): 6.085192
-2024-12-14 00:40:45,448 - INFO - parsing ../problem_instances/problem_instance.ru_macho.b78a10f2-ce8a-43c0-69ec-4cf666d8e85c.json
-2024-12-14 00:40:45,449 - INFO - problem_instance UUID: b78a10f2-ce8a-43c0-69ec-4cf666d8e85c
-2024-12-14 00:40:45,449 - INFO - problem_instance short name: ru_macho
-2024-12-14 00:40:45,449 - INFO - contains 9 associated Hamiltonians.
-2024-12-14 00:40:45,466 - INFO - Analyzing task 4357d5bb-ed2b-466a-947b-e868afb81d3d...
-2024-12-14 00:40:45,467 - INFO - number of supporting files: 1
-2024-12-14 00:40:45,467 - INFO - supporting data file UUID: 1dc29784-ab7f-45a1-9821-31fea4363d74.
-2024-12-14 00:40:45,467 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz.
-2024-12-14 00:40:45,467 - INFO - assuming fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz is an FCIDUMP file.
-2024-12-14 00:40:45,467 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz...
-2024-12-14 00:40:45,473 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:40:46,131 - INFO - Authentication (publickey) successful!
-2024-12-14 00:40:46,147 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:40:46,420 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:40:46,423 - INFO - ===============================================
-2024-12-14 00:40:46,423 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:40:48,170 - INFO - Circuit initialization time: 1.745921 seconds.
-2024-12-14 00:40:48,170 - INFO - Estimating logical resources...
-2024-12-14 00:40:48,734 - INFO - Resource estimation time (seconds): 0.563967
-2024-12-14 00:40:48,735 - INFO - Analyzing task b164af91-a758-445c-8e78-610ffd2ad795...
-2024-12-14 00:40:48,735 - INFO - number of supporting files: 1
-2024-12-14 00:40:48,735 - INFO - supporting data file UUID: 5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.
-2024-12-14 00:40:48,735 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz.
-2024-12-14 00:40:48,736 - INFO - assuming fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz is an FCIDUMP file.
-2024-12-14 00:40:48,736 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz...
-2024-12-14 00:40:48,741 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:40:49,389 - INFO - Authentication (publickey) successful!
-2024-12-14 00:40:49,410 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:40:49,460 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:40:49,465 - INFO - ===============================================
-2024-12-14 00:40:49,465 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:40:52,730 - INFO - Circuit initialization time: 3.264664 seconds.
-2024-12-14 00:40:52,730 - INFO - Estimating logical resources...
-2024-12-14 00:40:53,973 - INFO - Resource estimation time (seconds): 1.242734
-2024-12-14 00:40:53,974 - INFO - Analyzing task 28bd4997-c04c-4914-9984-0101713041fe...
-2024-12-14 00:40:53,974 - INFO - number of supporting files: 1
-2024-12-14 00:40:53,974 - INFO - supporting data file UUID: 587f69a8-4295-4d6d-811e-0eacfbc5f6dd.
-2024-12-14 00:40:53,974 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz.
-2024-12-14 00:40:53,974 - INFO - assuming fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz is an FCIDUMP file.
-2024-12-14 00:40:53,975 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz...
-2024-12-14 00:40:53,980 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:40:54,677 - INFO - Authentication (publickey) successful!
-2024-12-14 00:40:54,692 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:40:54,749 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:40:54,767 - INFO - ===============================================
-2024-12-14 00:40:54,768 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:41:06,867 - INFO - Circuit initialization time: 12.099072 seconds.
-2024-12-14 00:41:06,867 - INFO - Estimating logical resources...
-2024-12-14 00:41:10,306 - INFO - Resource estimation time (seconds): 3.438362
-2024-12-14 00:41:10,306 - INFO - Analyzing task dcf2b441-b297-4a89-ae18-5778ec2d674d...
-2024-12-14 00:41:10,306 - INFO - number of supporting files: 1
-2024-12-14 00:41:10,306 - INFO - supporting data file UUID: 46aea10c-d57f-4133-9837-3c57d474d9a2.
-2024-12-14 00:41:10,306 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz.
-2024-12-14 00:41:10,306 - INFO - assuming fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz is an FCIDUMP file.
-2024-12-14 00:41:10,306 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz...
-2024-12-14 00:41:10,312 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:41:10,968 - INFO - Authentication (publickey) successful!
-2024-12-14 00:41:10,983 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:41:11,039 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:41:11,050 - INFO - ===============================================
-2024-12-14 00:41:11,050 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:41:18,246 - INFO - Circuit initialization time: 7.195597 seconds.
-2024-12-14 00:41:18,246 - INFO - Estimating logical resources...
-2024-12-14 00:41:20,332 - INFO - Resource estimation time (seconds): 2.085523
-2024-12-14 00:41:20,332 - INFO - Analyzing task 6346b7fe-a4a5-4b10-a79b-706d4339923e...
-2024-12-14 00:41:20,332 - INFO - number of supporting files: 1
-2024-12-14 00:41:20,332 - INFO - supporting data file UUID: 496aaf89-2cdf-43cf-8b25-246e915cc8b5.
-2024-12-14 00:41:20,332 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz.
-2024-12-14 00:41:20,332 - INFO - assuming fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz is an FCIDUMP file.
-2024-12-14 00:41:20,332 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz...
-2024-12-14 00:41:20,337 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:41:20,986 - INFO - Authentication (publickey) successful!
-2024-12-14 00:41:21,002 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:41:21,100 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:41:21,608 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 00:41:21,608 - INFO - Analyzing task 68db6781-dd54-43c4-b667-7b754c4d5cdb...
-2024-12-14 00:41:21,608 - INFO - number of supporting files: 1
-2024-12-14 00:41:21,608 - INFO - supporting data file UUID: 0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.
-2024-12-14 00:41:21,608 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz.
-2024-12-14 00:41:21,609 - INFO - assuming fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz is an FCIDUMP file.
-2024-12-14 00:41:21,609 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz...
-2024-12-14 00:41:21,614 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:41:22,282 - INFO - Authentication (publickey) successful!
-2024-12-14 00:41:22,296 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:41:22,369 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:41:22,491 - INFO - ===============================================
-2024-12-14 00:41:22,491 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:42:42,735 - INFO - Circuit initialization time: 80.243604 seconds.
-2024-12-14 00:42:42,735 - INFO - Estimating logical resources...
-2024-12-14 00:42:56,304 - INFO - Resource estimation time (seconds): 13.569326
-2024-12-14 00:42:56,305 - INFO - Analyzing task d3ecd428-ee03-4d8b-aa14-af4d935781ed...
-2024-12-14 00:42:56,305 - INFO - number of supporting files: 1
-2024-12-14 00:42:56,305 - INFO - supporting data file UUID: e5e63f77-dbaa-431c-a53f-93c0f4c0758d.
-2024-12-14 00:42:56,305 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz.
-2024-12-14 00:42:56,305 - INFO - assuming fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz is an FCIDUMP file.
-2024-12-14 00:42:56,305 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz...
-2024-12-14 00:42:56,311 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:42:56,820 - INFO - Authentication (publickey) successful!
-2024-12-14 00:42:56,833 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:42:57,103 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:42:58,967 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 00:42:58,967 - INFO - Analyzing task 89253c8f-0f01-4046-a138-1bada22f0a6a...
-2024-12-14 00:42:58,967 - INFO - number of supporting files: 1
-2024-12-14 00:42:58,967 - INFO - supporting data file UUID: d7bea809-6e34-49f8-8daf-8d728dd18268.
-2024-12-14 00:42:58,967 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz.
-2024-12-14 00:42:58,967 - INFO - assuming fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz is an FCIDUMP file.
-2024-12-14 00:42:58,967 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz...
-2024-12-14 00:42:58,975 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:42:59,625 - INFO - Authentication (publickey) successful!
-2024-12-14 00:42:59,640 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:42:59,706 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:42:59,796 - INFO - ===============================================
-2024-12-14 00:42:59,796 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:43:53,684 - INFO - Circuit initialization time: 53.888095 seconds.
-2024-12-14 00:43:53,684 - INFO - Estimating logical resources...
-2024-12-14 00:44:04,036 - INFO - Resource estimation time (seconds): 10.351246
-2024-12-14 00:44:04,036 - INFO - Analyzing task 842d2152-2f91-4dce-b088-7ed26afb2381...
-2024-12-14 00:44:04,036 - INFO - number of supporting files: 1
-2024-12-14 00:44:04,036 - INFO - supporting data file UUID: 73ae455f-a729-4fac-a626-5654b03c1ef5.
-2024-12-14 00:44:04,036 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz.
-2024-12-14 00:44:04,036 - INFO - assuming fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz is an FCIDUMP file.
-2024-12-14 00:44:04,036 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz...
-2024-12-14 00:44:04,041 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:44:04,691 - INFO - Authentication (publickey) successful!
-2024-12-14 00:44:04,710 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:44:04,922 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:44:06,274 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 00:44:06,276 - INFO - parsing ../problem_instances/problem_instance.Cu_1.d5c7ab73-dfc1-499e-9027-601476004107.json
-2024-12-14 00:44:06,276 - INFO - problem_instance UUID: d5c7ab73-dfc1-499e-9027-601476004107
-2024-12-14 00:44:06,276 - INFO - problem_instance short name: Cu_1
-2024-12-14 00:44:06,276 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:44:06,291 - INFO - Analyzing task 5f5fee92-5821-4d38-a54a-d204660f205f...
-2024-12-14 00:44:06,291 - INFO - number of supporting files: 2
-2024-12-14 00:44:06,291 - INFO - supporting data file UUID: 6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.
-2024-12-14 00:44:06,291 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz.
-2024-12-14 00:44:06,291 - INFO - assuming fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz is an FCIDUMP file.
-2024-12-14 00:44:06,291 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz...
-2024-12-14 00:44:06,300 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:44:06,938 - INFO - Authentication (publickey) successful!
-2024-12-14 00:44:06,960 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:44:07,641 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:44:11,251 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 00:44:11,252 - INFO - supporting data file UUID: 36737c9f-2f69-4963-91a1-daf7a2a3fcfd.
-2024-12-14 00:44:11,252 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu1_vdz.36737c9f-2f69-4963-91a1-daf7a2a3fcfd.chk.
-2024-12-14 00:44:11,252 - INFO - assuming Cu1_vdz.36737c9f-2f69-4963-91a1-daf7a2a3fcfd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:44:11,252 - INFO - Analyzing task 1c7f5399-8982-4daf-81a5-7cef4e4588cc...
-2024-12-14 00:44:11,252 - INFO - number of supporting files: 2
-2024-12-14 00:44:11,252 - INFO - supporting data file UUID: 68952c71-d281-40fa-bcd2-cb0352f70a89.
-2024-12-14 00:44:11,252 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz.
-2024-12-14 00:44:11,252 - INFO - assuming fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz is an FCIDUMP file.
-2024-12-14 00:44:11,252 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz...
-2024-12-14 00:44:11,257 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:44:11,744 - INFO - Authentication (publickey) successful!
-2024-12-14 00:44:11,760 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:44:35,185 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:44:59,793 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:44:59,793 - INFO - supporting data file UUID: d9bbc858-2cef-43ee-896f-c9059d2b13b5.
-2024-12-14 00:44:59,793 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu1_vtz.d9bbc858-2cef-43ee-896f-c9059d2b13b5.chk.
-2024-12-14 00:44:59,793 - INFO - assuming Cu1_vtz.d9bbc858-2cef-43ee-896f-c9059d2b13b5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:44:59,795 - INFO - parsing ../problem_instances/problem_instance.n_h3_0.127cfea5-8a7d-45a0-9012-949816a0b8d9.json
-2024-12-14 00:44:59,795 - INFO - problem_instance UUID: 127cfea5-8a7d-45a0-9012-949816a0b8d9
-2024-12-14 00:44:59,795 - INFO - problem_instance short name: n_h3_0
-2024-12-14 00:44:59,795 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:44:59,810 - INFO - Analyzing task 77c3a92c-066c-4043-a4a1-5e8324014d0b...
-2024-12-14 00:44:59,810 - INFO - number of supporting files: 2
-2024-12-14 00:44:59,810 - INFO - supporting data file UUID: 9820e181-088a-4b00-8a14-8cafb952ccdd.
-2024-12-14 00:44:59,810 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz.
-2024-12-14 00:44:59,810 - INFO - assuming fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz is an FCIDUMP file.
-2024-12-14 00:44:59,811 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz...
-2024-12-14 00:44:59,821 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:45:00,533 - INFO - Authentication (publickey) successful!
-2024-12-14 00:45:00,565 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:45:00,765 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:45:01,339 - INFO - ===============================================
-2024-12-14 00:45:01,339 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:47:56,022 - INFO - Circuit initialization time: 174.682485 seconds.
-2024-12-14 00:47:56,022 - INFO - Estimating logical resources...
-2024-12-14 00:48:22,357 - INFO - Resource estimation time (seconds): 26.335105
-2024-12-14 00:48:22,358 - INFO - supporting data file UUID: e3cda046-ae0d-47d9-b012-7f1e5f632f71.
-2024-12-14 00:48:22,358 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n_h3_cc-pVDZ.e3cda046-ae0d-47d9-b012-7f1e5f632f71.chk.
-2024-12-14 00:48:22,358 - INFO - assuming n_h3_cc-pVDZ.e3cda046-ae0d-47d9-b012-7f1e5f632f71.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:48:22,358 - INFO - Analyzing task 1094e868-f84e-403b-9b54-50802b1cdb60...
-2024-12-14 00:48:22,358 - INFO - number of supporting files: 2
-2024-12-14 00:48:22,358 - INFO - supporting data file UUID: 3b423f54-aa64-4331-a59b-d6c37de1fbb6.
-2024-12-14 00:48:22,358 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz.
-2024-12-14 00:48:22,358 - INFO - assuming fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz is an FCIDUMP file.
-2024-12-14 00:48:22,358 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz...
-2024-12-14 00:48:22,363 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:48:23,031 - INFO - Authentication (publickey) successful!
-2024-12-14 00:48:23,047 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:48:40,730 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:49:02,710 - INFO - Skipping Logical Resource Estimate because number of orbitals (72) exceeds maximum specified in config (32).
-2024-12-14 00:49:02,710 - INFO - supporting data file UUID: 15125674-abf8-4db2-9db6-9d293b677584.
-2024-12-14 00:49:02,710 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n_h3_cc-pVTZ.15125674-abf8-4db2-9db6-9d293b677584.chk.
-2024-12-14 00:49:02,710 - INFO - assuming n_h3_cc-pVTZ.15125674-abf8-4db2-9db6-9d293b677584.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:49:02,712 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0006.42958a3e-8b35-4992-acd8-6711848066c1.json
-2024-12-14 00:49:02,751 - INFO - problem_instance UUID: 42958a3e-8b35-4992-acd8-6711848066c1
-2024-12-14 00:49:02,751 - INFO - problem_instance short name: planted_solution_0006
-2024-12-14 00:49:02,752 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:49:02,767 - INFO - Analyzing task d28f02ba-d43f-4df9-a01a-f1e8ac326e08...
-2024-12-14 00:49:02,767 - INFO - number of supporting files: 1
-2024-12-14 00:49:02,767 - INFO - supporting data file UUID: a4b9a6bd-4479-44b2-b172-642f74396781.
-2024-12-14 00:49:02,767 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz.
-2024-12-14 00:49:02,767 - INFO - assuming fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz is an FCIDUMP file.
-2024-12-14 00:49:02,767 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz...
-2024-12-14 00:49:02,775 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:49:03,429 - INFO - Authentication (publickey) successful!
-2024-12-14 00:49:03,445 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:49:03,504 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:49:03,526 - INFO - ===============================================
-2024-12-14 00:49:03,526 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:49:13,176 - INFO - Circuit initialization time: 9.650329 seconds.
-2024-12-14 00:49:13,176 - INFO - Estimating logical resources...
-2024-12-14 00:49:14,745 - INFO - Resource estimation time (seconds): 1.568107
-2024-12-14 00:49:14,747 - INFO - parsing ../problem_instances/problem_instance.n2_h4_0.f1a6b508-75e8-4afb-9c81-fc61af11b523.json
-2024-12-14 00:49:14,747 - INFO - problem_instance UUID: f1a6b508-75e8-4afb-9c81-fc61af11b523
-2024-12-14 00:49:14,747 - INFO - problem_instance short name: n2_h4_0
-2024-12-14 00:49:14,747 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:49:14,761 - INFO - Analyzing task 828c931b-4d5a-486e-ba26-abb293c1ccef...
-2024-12-14 00:49:14,761 - INFO - number of supporting files: 2
-2024-12-14 00:49:14,761 - INFO - supporting data file UUID: aba33661-3ce8-4f28-824f-e98244906d94.
-2024-12-14 00:49:14,762 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz.
-2024-12-14 00:49:14,762 - INFO - assuming fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz is an FCIDUMP file.
-2024-12-14 00:49:14,762 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz...
-2024-12-14 00:49:14,767 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:49:15,415 - INFO - Authentication (publickey) successful!
-2024-12-14 00:49:15,434 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:49:16,864 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:49:21,418 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 00:49:21,418 - INFO - supporting data file UUID: 93193d14-3f99-4495-bcf8-e60f9d863904.
-2024-12-14 00:49:21,418 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_h4_cc-pVDZ.93193d14-3f99-4495-bcf8-e60f9d863904.chk.
-2024-12-14 00:49:21,418 - INFO - assuming n2_h4_cc-pVDZ.93193d14-3f99-4495-bcf8-e60f9d863904.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:49:21,420 - INFO - parsing ../problem_instances/problem_instance.c2_h4_0.9fbd9b4c-5ea9-4095-af7b-7d4491399e42.json
-2024-12-14 00:49:21,420 - INFO - problem_instance UUID: 9fbd9b4c-5ea9-4095-af7b-7d4491399e42
-2024-12-14 00:49:21,420 - INFO - problem_instance short name: c2_h4_0
-2024-12-14 00:49:21,420 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:49:21,434 - INFO - Analyzing task 26423f2e-e3e1-4bbb-b2ff-52bdae87d65b...
-2024-12-14 00:49:21,435 - INFO - number of supporting files: 2
-2024-12-14 00:49:21,435 - INFO - supporting data file UUID: 40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.
-2024-12-14 00:49:21,435 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz.
-2024-12-14 00:49:21,435 - INFO - assuming fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz is an FCIDUMP file.
-2024-12-14 00:49:21,435 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz...
-2024-12-14 00:49:21,440 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:49:22,092 - INFO - Authentication (publickey) successful!
-2024-12-14 00:49:22,107 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:49:22,315 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:49:23,812 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 00:49:23,812 - INFO - supporting data file UUID: f563c847-e680-4452-8320-aa3b4e8aa3b7.
-2024-12-14 00:49:23,812 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h4_cc-pVDZ.f563c847-e680-4452-8320-aa3b4e8aa3b7.chk.
-2024-12-14 00:49:23,812 - INFO - assuming c2_h4_cc-pVDZ.f563c847-e680-4452-8320-aa3b4e8aa3b7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:49:23,812 - INFO - Analyzing task 9757b7c2-d420-4ebb-8da7-38238951a5ca...
-2024-12-14 00:49:23,812 - INFO - number of supporting files: 2
-2024-12-14 00:49:23,812 - INFO - supporting data file UUID: 4bd40563-25e1-4334-bf15-3ccd36c05ab2.
-2024-12-14 00:49:23,812 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz.
-2024-12-14 00:49:23,812 - INFO - assuming fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz is an FCIDUMP file.
-2024-12-14 00:49:23,812 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz...
-2024-12-14 00:49:23,818 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:49:24,543 - INFO - Authentication (publickey) successful!
-2024-12-14 00:49:24,558 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:50:41,063 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:51:23,354 - INFO - Skipping Logical Resource Estimate because number of orbitals (116) exceeds maximum specified in config (32).
-2024-12-14 00:51:23,354 - INFO - supporting data file UUID: d4db7859-f494-41d7-8658-56dcb50831b4.
-2024-12-14 00:51:23,354 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h4_cc-pVTZ.d4db7859-f494-41d7-8658-56dcb50831b4.chk.
-2024-12-14 00:51:23,354 - INFO - assuming c2_h4_cc-pVTZ.d4db7859-f494-41d7-8658-56dcb50831b4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:51:23,373 - INFO - parsing ../problem_instances/problem_instance.O_1.d712afaf-6ec4-42d9-b5fd-1edee3ec1046.json
-2024-12-14 00:51:23,374 - INFO - problem_instance UUID: d712afaf-6ec4-42d9-b5fd-1edee3ec1046
-2024-12-14 00:51:23,374 - INFO - problem_instance short name: O_1
-2024-12-14 00:51:23,374 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:51:23,390 - INFO - Analyzing task 752966e5-7de7-4506-82ae-6b22cd54b1c1...
-2024-12-14 00:51:23,390 - INFO - number of supporting files: 2
-2024-12-14 00:51:23,390 - INFO - supporting data file UUID: 0767fb16-25bd-4f1c-b134-6b536191b36e.
-2024-12-14 00:51:23,390 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz.
-2024-12-14 00:51:23,390 - INFO - assuming fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz is an FCIDUMP file.
-2024-12-14 00:51:23,390 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz...
-2024-12-14 00:51:23,395 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:51:23,933 - INFO - Authentication (publickey) successful!
-2024-12-14 00:51:23,949 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:51:24,028 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:51:24,134 - INFO - ===============================================
-2024-12-14 00:51:24,135 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:52:05,101 - INFO - Circuit initialization time: 40.966688 seconds.
-2024-12-14 00:52:05,102 - INFO - Estimating logical resources...
-2024-12-14 00:52:13,045 - INFO - Resource estimation time (seconds): 7.942973
-2024-12-14 00:52:13,045 - INFO - supporting data file UUID: db942588-339b-4fb6-a293-f853ebb812d7.
-2024-12-14 00:52:13,045 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vdz.db942588-339b-4fb6-a293-f853ebb812d7.chk.
-2024-12-14 00:52:13,045 - INFO - assuming O1_vdz.db942588-339b-4fb6-a293-f853ebb812d7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:52:13,045 - INFO - Analyzing task 64122cc6-e1bb-4c11-8d00-2189d27194f1...
-2024-12-14 00:52:13,045 - INFO - number of supporting files: 2
-2024-12-14 00:52:13,045 - INFO - supporting data file UUID: 3b587c2c-9579-4c7b-8b3f-e00c69c42981.
-2024-12-14 00:52:13,045 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz.
-2024-12-14 00:52:13,045 - INFO - assuming fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz is an FCIDUMP file.
-2024-12-14 00:52:13,045 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz...
-2024-12-14 00:52:13,051 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:52:13,557 - INFO - Authentication (publickey) successful!
-2024-12-14 00:52:13,572 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:52:22,378 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:52:36,905 - INFO - Skipping Logical Resource Estimate because number of orbitals (79) exceeds maximum specified in config (32).
-2024-12-14 00:52:36,905 - INFO - supporting data file UUID: 9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.
-2024-12-14 00:52:36,905 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vqz.9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.chk.
-2024-12-14 00:52:36,905 - INFO - assuming O1_vqz.9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:52:36,905 - INFO - Analyzing task f9bdbb3b-91b6-43f3-93ca-bef1e10d3835...
-2024-12-14 00:52:36,905 - INFO - number of supporting files: 2
-2024-12-14 00:52:36,905 - INFO - supporting data file UUID: ee1c9912-bca9-42fa-a90d-421e9a26c785.
-2024-12-14 00:52:36,905 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz.
-2024-12-14 00:52:36,906 - INFO - assuming fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz is an FCIDUMP file.
-2024-12-14 00:52:36,906 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz...
-2024-12-14 00:52:36,910 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:52:37,549 - INFO - Authentication (publickey) successful!
-2024-12-14 00:52:37,566 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:52:37,819 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:52:39,353 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 00:52:39,353 - INFO - supporting data file UUID: b295de3f-c1ac-42ed-baf4-97cc52e0dba2.
-2024-12-14 00:52:39,353 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vtz.b295de3f-c1ac-42ed-baf4-97cc52e0dba2.chk.
-2024-12-14 00:52:39,353 - INFO - assuming O1_vtz.b295de3f-c1ac-42ed-baf4-97cc52e0dba2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:52:39,355 - INFO - parsing ../problem_instances/problem_instance.cr_dimer.8ed1a800-a4c6-4bff-a6de-cb220554c42f.json
-2024-12-14 00:52:39,355 - INFO - problem_instance UUID: 8ed1a800-a4c6-4bff-a6de-cb220554c42f
-2024-12-14 00:52:39,355 - INFO - problem_instance short name: cr_dimer
-2024-12-14 00:52:39,355 - INFO - contains 12 associated Hamiltonians.
-2024-12-14 00:52:39,366 - INFO - Analyzing task 9030e9c9-0323-413c-a98e-aba16b180ba7...
-2024-12-14 00:52:39,366 - INFO - number of supporting files: 1
-2024-12-14 00:52:39,366 - INFO - supporting data file UUID: 3092dd74-660d-4c7a-9d43-16d1436e084b.
-2024-12-14 00:52:39,366 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz.
-2024-12-14 00:52:39,366 - INFO - assuming FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz is an FCIDUMP file.
-2024-12-14 00:52:39,366 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz...
-2024-12-14 00:52:39,371 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:52:40,071 - INFO - Authentication (publickey) successful!
-2024-12-14 00:52:40,088 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:52:40,154 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:52:40,205 - INFO - ===============================================
-2024-12-14 00:52:40,205 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:52:57,842 - INFO - Circuit initialization time: 17.636325 seconds.
-2024-12-14 00:52:57,842 - INFO - Estimating logical resources...
-2024-12-14 00:53:02,767 - INFO - Resource estimation time (seconds): 4.924692
-2024-12-14 00:53:02,767 - INFO - Analyzing task c7c653b0-4440-4a36-a66b-8b81a9a351c7...
-2024-12-14 00:53:02,767 - INFO - number of supporting files: 1
-2024-12-14 00:53:02,767 - INFO - supporting data file UUID: 96843098-e69d-4d1f-8a88-5b24826f7390.
-2024-12-14 00:53:02,767 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz.
-2024-12-14 00:53:02,767 - INFO - assuming FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz is an FCIDUMP file.
-2024-12-14 00:53:02,767 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz...
-2024-12-14 00:53:02,772 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:53:03,432 - INFO - Authentication (publickey) successful!
-2024-12-14 00:53:03,448 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:53:03,513 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:53:03,711 - INFO - ===============================================
-2024-12-14 00:53:03,711 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:54:15,344 - INFO - Circuit initialization time: 71.633235 seconds.
-2024-12-14 00:54:15,344 - INFO - Estimating logical resources...
-2024-12-14 00:54:30,067 - INFO - Resource estimation time (seconds): 14.722011
-2024-12-14 00:54:30,067 - INFO - Analyzing task 82f35801-6276-4090-a9aa-b821d94708d4...
-2024-12-14 00:54:30,067 - INFO - number of supporting files: 1
-2024-12-14 00:54:30,067 - INFO - supporting data file UUID: 673dfe91-d90e-4ecd-8560-d6d74de11070.
-2024-12-14 00:54:30,067 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz.
-2024-12-14 00:54:30,067 - INFO - assuming FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz is an FCIDUMP file.
-2024-12-14 00:54:30,067 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz...
-2024-12-14 00:54:30,072 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:54:30,712 - INFO - Authentication (publickey) successful!
-2024-12-14 00:54:30,728 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:54:33,942 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:54:43,390 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 00:54:43,391 - INFO - Analyzing task 362386c9-f0c2-483e-a64d-52208ab9bbc1...
-2024-12-14 00:54:43,391 - INFO - number of supporting files: 1
-2024-12-14 00:54:43,391 - INFO - supporting data file UUID: 4412b7d6-86db-4616-9dd2-2c32ee02560f.
-2024-12-14 00:54:43,391 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz.
-2024-12-14 00:54:43,391 - INFO - assuming FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz is an FCIDUMP file.
-2024-12-14 00:54:43,391 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz...
-2024-12-14 00:54:43,399 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:54:43,927 - INFO - Authentication (publickey) successful!
-2024-12-14 00:54:43,939 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:54:51,456 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:55:04,782 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 00:55:04,782 - INFO - Analyzing task 61ad4cfe-b057-4dd8-bd06-ed56347745c1...
-2024-12-14 00:55:04,782 - INFO - number of supporting files: 1
-2024-12-14 00:55:04,782 - INFO - supporting data file UUID: cdf017c4-7c30-4274-9567-f5e55a6ba857.
-2024-12-14 00:55:04,782 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz.
-2024-12-14 00:55:04,782 - INFO - assuming FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz is an FCIDUMP file.
-2024-12-14 00:55:04,782 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz...
-2024-12-14 00:55:04,790 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:55:05,333 - INFO - Authentication (publickey) successful!
-2024-12-14 00:55:05,346 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:55:05,397 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:55:05,448 - INFO - ===============================================
-2024-12-14 00:55:05,448 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:55:25,898 - INFO - Circuit initialization time: 20.449708 seconds.
-2024-12-14 00:55:25,898 - INFO - Estimating logical resources...
-2024-12-14 00:55:30,498 - INFO - Resource estimation time (seconds): 4.599987
-2024-12-14 00:55:30,498 - INFO - Analyzing task fc25a232-d249-4e1c-a9ec-360cab33f779...
-2024-12-14 00:55:30,499 - INFO - number of supporting files: 1
-2024-12-14 00:55:30,499 - INFO - supporting data file UUID: d9341cde-90e8-4d1e-beb2-4e40246d31ce.
-2024-12-14 00:55:30,499 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz.
-2024-12-14 00:55:30,499 - INFO - assuming FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz is an FCIDUMP file.
-2024-12-14 00:55:30,499 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz...
-2024-12-14 00:55:30,504 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:55:31,049 - INFO - Authentication (publickey) successful!
-2024-12-14 00:55:31,067 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:55:31,128 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:55:31,348 - INFO - ===============================================
-2024-12-14 00:55:31,348 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:56:59,066 - INFO - Circuit initialization time: 87.716987 seconds.
-2024-12-14 00:56:59,066 - INFO - Estimating logical resources...
-2024-12-14 00:57:11,882 - INFO - Resource estimation time (seconds): 12.816292
-2024-12-14 00:57:11,882 - INFO - Analyzing task b99ec02f-b46a-43fe-8a87-1b3286e072d8...
-2024-12-14 00:57:11,882 - INFO - number of supporting files: 1
-2024-12-14 00:57:11,882 - INFO - supporting data file UUID: 5439a548-153b-4990-be12-f0e33c30fe63.
-2024-12-14 00:57:11,882 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz.
-2024-12-14 00:57:11,883 - INFO - assuming FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz is an FCIDUMP file.
-2024-12-14 00:57:11,883 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz...
-2024-12-14 00:57:11,887 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:57:12,524 - INFO - Authentication (publickey) successful!
-2024-12-14 00:57:12,539 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:57:16,142 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:57:25,413 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 00:57:25,414 - INFO - Analyzing task 8874bf11-f594-41df-b8a0-d2a7441904a1...
-2024-12-14 00:57:25,414 - INFO - number of supporting files: 1
-2024-12-14 00:57:25,414 - INFO - supporting data file UUID: e2995852-9911-4021-a82f-5b14ddb2d5c8.
-2024-12-14 00:57:25,414 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz.
-2024-12-14 00:57:25,414 - INFO - assuming FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz is an FCIDUMP file.
-2024-12-14 00:57:25,414 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz...
-2024-12-14 00:57:25,419 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:57:26,113 - INFO - Authentication (publickey) successful!
-2024-12-14 00:57:26,129 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:57:33,725 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:57:45,997 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 00:57:45,997 - INFO - Analyzing task 202e6184-1e7d-4c02-a82a-f588b6abf809...
-2024-12-14 00:57:45,997 - INFO - number of supporting files: 1
-2024-12-14 00:57:45,997 - INFO - supporting data file UUID: 67acc90d-1a9e-49a7-98a1-8ca643dca272.
-2024-12-14 00:57:45,997 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz.
-2024-12-14 00:57:45,997 - INFO - assuming FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz is an FCIDUMP file.
-2024-12-14 00:57:45,997 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz...
-2024-12-14 00:57:46,002 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:57:46,646 - INFO - Authentication (publickey) successful!
-2024-12-14 00:57:46,667 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:57:46,720 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:57:46,772 - INFO - ===============================================
-2024-12-14 00:57:46,772 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:58:07,470 - INFO - Circuit initialization time: 20.697991 seconds.
-2024-12-14 00:58:07,470 - INFO - Estimating logical resources...
-2024-12-14 00:58:12,600 - INFO - Resource estimation time (seconds): 5.12968
-2024-12-14 00:58:12,600 - INFO - Analyzing task 7c8f0a36-cda5-4b33-bb46-4e58a15b37a1...
-2024-12-14 00:58:12,601 - INFO - number of supporting files: 1
-2024-12-14 00:58:12,601 - INFO - supporting data file UUID: 01d526fb-276e-4369-85d4-66a553a1d02e.
-2024-12-14 00:58:12,601 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz.
-2024-12-14 00:58:12,601 - INFO - assuming FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz is an FCIDUMP file.
-2024-12-14 00:58:12,601 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz...
-2024-12-14 00:58:12,606 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:58:13,244 - INFO - Authentication (publickey) successful!
-2024-12-14 00:58:13,259 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:58:13,321 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:58:13,525 - INFO - ===============================================
-2024-12-14 00:58:13,526 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 00:59:35,764 - INFO - Circuit initialization time: 82.238035 seconds.
-2024-12-14 00:59:35,764 - INFO - Estimating logical resources...
-2024-12-14 00:59:47,555 - INFO - Resource estimation time (seconds): 11.791306
-2024-12-14 00:59:47,556 - INFO - Analyzing task cbab5937-5e2f-4f3f-819e-ede8b66d7238...
-2024-12-14 00:59:47,556 - INFO - number of supporting files: 1
-2024-12-14 00:59:47,556 - INFO - supporting data file UUID: b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.
-2024-12-14 00:59:47,556 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz.
-2024-12-14 00:59:47,556 - INFO - assuming FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz is an FCIDUMP file.
-2024-12-14 00:59:47,556 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz...
-2024-12-14 00:59:47,560 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:59:48,198 - INFO - Authentication (publickey) successful!
-2024-12-14 00:59:48,214 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:59:51,286 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:00:00,634 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 01:00:00,635 - INFO - Analyzing task c28e09e1-5983-42f7-9ecb-b271438ebcc8...
-2024-12-14 01:00:00,635 - INFO - number of supporting files: 1
-2024-12-14 01:00:00,635 - INFO - supporting data file UUID: 2101e6fa-9fb3-4697-98be-25a4e0de2079.
-2024-12-14 01:00:00,635 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz.
-2024-12-14 01:00:00,635 - INFO - assuming FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz is an FCIDUMP file.
-2024-12-14 01:00:00,635 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz...
-2024-12-14 01:00:00,648 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:00:01,356 - INFO - Authentication (publickey) successful!
-2024-12-14 01:00:01,382 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:00:10,264 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:00:24,532 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 01:00:24,537 - INFO - parsing ../problem_instances/problem_instance.be_0.19cada59-64cc-466c-8809-782a4f574dcc.json
-2024-12-14 01:00:24,537 - INFO - problem_instance UUID: 19cada59-64cc-466c-8809-782a4f574dcc
-2024-12-14 01:00:24,537 - INFO - problem_instance short name: be_0
-2024-12-14 01:00:24,537 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 01:00:24,552 - INFO - Skipping task 3fb92ecd-bcbc-43dd-9f29-aa56ea646b75 because no overlap was provided.
-2024-12-14 01:00:24,552 - INFO - Analyzing task afdc2f74-eb52-41ae-b72a-30e5a4c07013...
-2024-12-14 01:00:24,553 - INFO - number of supporting files: 2
-2024-12-14 01:00:24,553 - INFO - supporting data file UUID: f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.
-2024-12-14 01:00:24,553 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz.
-2024-12-14 01:00:24,553 - INFO - assuming fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz is an FCIDUMP file.
-2024-12-14 01:00:24,553 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz...
-2024-12-14 01:00:24,566 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:00:25,181 - INFO - Authentication (publickey) successful!
-2024-12-14 01:00:25,195 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:00:25,870 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:00:29,557 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 01:00:29,557 - INFO - supporting data file UUID: 26c5cd51-33c9-4c10-969e-07daa488861d.
-2024-12-14 01:00:29,557 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/be_cc-pVQZ.26c5cd51-33c9-4c10-969e-07daa488861d.chk.
-2024-12-14 01:00:29,558 - INFO - assuming be_cc-pVQZ.26c5cd51-33c9-4c10-969e-07daa488861d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:00:29,558 - INFO - Analyzing task 543e2ed4-a12d-495b-a246-1e4d905ad4a3...
-2024-12-14 01:00:29,558 - INFO - number of supporting files: 2
-2024-12-14 01:00:29,558 - INFO - supporting data file UUID: fdc83bd0-c9bd-47da-abee-99b743b36494.
-2024-12-14 01:00:29,558 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz.
-2024-12-14 01:00:29,558 - INFO - assuming fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz is an FCIDUMP file.
-2024-12-14 01:00:29,558 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz...
-2024-12-14 01:00:29,564 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:00:30,212 - INFO - Authentication (publickey) successful!
-2024-12-14 01:00:30,232 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:00:30,354 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:00:30,669 - INFO - ===============================================
-2024-12-14 01:00:30,669 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 01:02:39,390 - INFO - Circuit initialization time: 128.72114 seconds.
-2024-12-14 01:02:39,390 - INFO - Estimating logical resources...
-2024-12-14 01:02:54,666 - INFO - Resource estimation time (seconds): 15.275538
-2024-12-14 01:02:54,666 - INFO - supporting data file UUID: fedfefb8-56ab-4bf5-8607-fe3950fd5962.
-2024-12-14 01:02:54,666 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/be_cc-pVTZ.fedfefb8-56ab-4bf5-8607-fe3950fd5962.chk.
-2024-12-14 01:02:54,666 - INFO - assuming be_cc-pVTZ.fedfefb8-56ab-4bf5-8607-fe3950fd5962.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:02:54,668 - INFO - parsing ../problem_instances/problem_instance.f2_0.e3e78b41-577d-4536-a63f-7e968eeb6493.json
-2024-12-14 01:02:54,669 - INFO - problem_instance UUID: e3e78b41-577d-4536-a63f-7e968eeb6493
-2024-12-14 01:02:54,669 - INFO - problem_instance short name: f2_0
-2024-12-14 01:02:54,669 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 01:02:54,683 - INFO - Analyzing task 94fc2317-29af-43a1-aaec-dade9850ca27...
-2024-12-14 01:02:54,684 - INFO - number of supporting files: 2
-2024-12-14 01:02:54,684 - INFO - supporting data file UUID: ac269a87-2bc4-458e-8f4a-64f524c77044.
-2024-12-14 01:02:54,684 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz.
-2024-12-14 01:02:54,684 - INFO - assuming fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz is an FCIDUMP file.
-2024-12-14 01:02:54,684 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz...
-2024-12-14 01:02:54,688 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:02:55,344 - INFO - Authentication (publickey) successful!
-2024-12-14 01:02:55,362 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:02:55,462 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:02:55,745 - INFO - ===============================================
-2024-12-14 01:02:55,745 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 01:04:21,579 - INFO - Circuit initialization time: 85.833565 seconds.
-2024-12-14 01:04:21,579 - INFO - Estimating logical resources...
-2024-12-14 01:04:34,727 - INFO - Resource estimation time (seconds): 13.148531
-2024-12-14 01:04:34,728 - INFO - supporting data file UUID: 6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.
-2024-12-14 01:04:34,728 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVDZ.6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.chk.
-2024-12-14 01:04:34,728 - INFO - assuming f2_cc-pVDZ.6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:04:34,728 - INFO - Analyzing task fa8e83f2-cec5-4609-9b77-d713608a6b53...
-2024-12-14 01:04:34,728 - INFO - number of supporting files: 2
-2024-12-14 01:04:34,728 - INFO - supporting data file UUID: 29d645f8-ce30-4e18-9f41-644ac5f9d922.
-2024-12-14 01:04:34,728 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz.
-2024-12-14 01:04:34,728 - INFO - assuming fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz is an FCIDUMP file.
-2024-12-14 01:04:34,728 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz...
-2024-12-14 01:04:34,733 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:04:35,386 - INFO - Authentication (publickey) successful!
-2024-12-14 01:04:35,402 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:06:38,717 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:07:37,467 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 01:07:37,467 - INFO - supporting data file UUID: 5c169867-7d8c-44d8-8b34-4ecc34cd9649.
-2024-12-14 01:07:37,467 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVQZ.5c169867-7d8c-44d8-8b34-4ecc34cd9649.chk.
-2024-12-14 01:07:37,467 - INFO - assuming f2_cc-pVQZ.5c169867-7d8c-44d8-8b34-4ecc34cd9649.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:07:37,468 - INFO - Analyzing task 3fb371ad-c738-40ae-b9ae-80e5bce8f2ac...
-2024-12-14 01:07:37,468 - INFO - number of supporting files: 2
-2024-12-14 01:07:37,468 - INFO - supporting data file UUID: 3c3967d4-17c1-4947-9465-b9223b01e694.
-2024-12-14 01:07:37,468 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz.
-2024-12-14 01:07:37,468 - INFO - assuming fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz is an FCIDUMP file.
-2024-12-14 01:07:37,468 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz...
-2024-12-14 01:07:37,473 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:07:38,113 - INFO - Authentication (publickey) successful!
-2024-12-14 01:07:38,126 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:07:39,092 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:07:43,663 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 01:07:43,663 - INFO - supporting data file UUID: 8627efa5-5412-4e91-9cd0-2a582c3c7c20.
-2024-12-14 01:07:43,663 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVTZ.8627efa5-5412-4e91-9cd0-2a582c3c7c20.chk.
-2024-12-14 01:07:43,663 - INFO - assuming f2_cc-pVTZ.8627efa5-5412-4e91-9cd0-2a582c3c7c20.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:07:43,665 - INFO - parsing ../problem_instances/problem_instance.n2_0.9bd9cde6-6daa-441a-984e-ae1c1c051e91.json
-2024-12-14 01:07:43,666 - INFO - problem_instance UUID: 9bd9cde6-6daa-441a-984e-ae1c1c051e91
-2024-12-14 01:07:43,666 - INFO - problem_instance short name: n2_0
-2024-12-14 01:07:43,666 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 01:07:43,681 - INFO - Analyzing task b9c35349-927d-47d5-8e0c-e054bbf4e4e0...
-2024-12-14 01:07:43,682 - INFO - number of supporting files: 2
-2024-12-14 01:07:43,682 - INFO - supporting data file UUID: 60c52c22-d27a-4544-8b9c-6022507611f9.
-2024-12-14 01:07:43,682 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz.
-2024-12-14 01:07:43,682 - INFO - assuming fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz is an FCIDUMP file.
-2024-12-14 01:07:43,682 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz...
-2024-12-14 01:07:43,687 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:07:44,321 - INFO - Authentication (publickey) successful!
-2024-12-14 01:07:44,335 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:07:44,415 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:07:44,655 - INFO - ===============================================
-2024-12-14 01:07:44,655 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 01:09:04,947 - INFO - Circuit initialization time: 80.292178 seconds.
-2024-12-14 01:09:04,948 - INFO - Estimating logical resources...
-2024-12-14 01:09:21,442 - INFO - Resource estimation time (seconds): 16.494559
-2024-12-14 01:09:21,443 - INFO - supporting data file UUID: a107e4ce-0b43-437a-8c59-c2c249d1798d.
-2024-12-14 01:09:21,443 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVDZ.a107e4ce-0b43-437a-8c59-c2c249d1798d.chk.
-2024-12-14 01:09:21,443 - INFO - assuming n2_cc-pVDZ.a107e4ce-0b43-437a-8c59-c2c249d1798d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:09:21,443 - INFO - Analyzing task 9eed79e4-b195-4474-b280-fe9166a7a241...
-2024-12-14 01:09:21,443 - INFO - number of supporting files: 2
-2024-12-14 01:09:21,443 - INFO - supporting data file UUID: e84ef191-bfe0-4859-96b9-0613cad743d4.
-2024-12-14 01:09:21,443 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz.
-2024-12-14 01:09:21,443 - INFO - assuming fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz is an FCIDUMP file.
-2024-12-14 01:09:21,443 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz...
-2024-12-14 01:09:21,448 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:09:22,111 - INFO - Authentication (publickey) successful!
-2024-12-14 01:09:22,130 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:11:10,363 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:04,179 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 01:12:04,180 - INFO - supporting data file UUID: bb706eb0-f001-4938-8b70-b9f742942f45.
-2024-12-14 01:12:04,180 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVQZ.bb706eb0-f001-4938-8b70-b9f742942f45.chk.
-2024-12-14 01:12:04,180 - INFO - assuming n2_cc-pVQZ.bb706eb0-f001-4938-8b70-b9f742942f45.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:12:04,180 - INFO - Analyzing task 666185aa-b65d-4f73-8846-ae9693388d9d...
-2024-12-14 01:12:04,180 - INFO - number of supporting files: 2
-2024-12-14 01:12:04,180 - INFO - supporting data file UUID: 48512c28-04a3-4e3b-b6b2-3e4b654c1887.
-2024-12-14 01:12:04,180 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz.
-2024-12-14 01:12:04,180 - INFO - assuming fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz is an FCIDUMP file.
-2024-12-14 01:12:04,180 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz...
-2024-12-14 01:12:04,187 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:04,807 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:04,823 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:05,814 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:10,650 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 01:12:10,650 - INFO - supporting data file UUID: 5235f91b-19a0-4122-b54f-99051ccf0480.
-2024-12-14 01:12:10,651 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVTZ.5235f91b-19a0-4122-b54f-99051ccf0480.chk.
-2024-12-14 01:12:10,651 - INFO - assuming n2_cc-pVTZ.5235f91b-19a0-4122-b54f-99051ccf0480.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:12:10,653 - INFO - parsing ../problem_instances/problem_instance.fe_red.a8895776-3583-4884-fbc7-d6f9df21a7ac.json
-2024-12-14 01:12:10,653 - INFO - problem_instance UUID: a8895776-3583-4884-fbc7-d6f9df21a7ac
-2024-12-14 01:12:10,653 - INFO - problem_instance short name: fe_red
-2024-12-14 01:12:10,653 - INFO - contains 9 associated Hamiltonians.
-2024-12-14 01:12:10,668 - INFO - Analyzing task 4970c526-817f-4c04-8d7e-797526d5948d...
-2024-12-14 01:12:10,668 - INFO - number of supporting files: 1
-2024-12-14 01:12:10,668 - INFO - supporting data file UUID: 79e71b3e-6364-4972-b4b3-07841fa8ba97.
-2024-12-14 01:12:10,668 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz.
-2024-12-14 01:12:10,668 - INFO - assuming fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz is an FCIDUMP file.
-2024-12-14 01:12:10,668 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz...
-2024-12-14 01:12:10,681 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:11,313 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:11,330 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:11,572 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:12,852 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 01:12:12,852 - INFO - Analyzing task d27fb590-4e90-4d5a-bdb8-37fbf22f528b...
-2024-12-14 01:12:12,852 - INFO - number of supporting files: 1
-2024-12-14 01:12:12,852 - INFO - supporting data file UUID: e8f72c80-2fde-4bdc-ac1e-07220942f1c2.
-2024-12-14 01:12:12,852 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz.
-2024-12-14 01:12:12,852 - INFO - assuming fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz is an FCIDUMP file.
-2024-12-14 01:12:12,852 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz...
-2024-12-14 01:12:12,858 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:13,543 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:13,560 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:14,148 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:17,528 - INFO - Skipping Logical Resource Estimate because number of orbitals (53) exceeds maximum specified in config (32).
-2024-12-14 01:12:17,528 - INFO - Analyzing task a7cd2501-2f67-4fcd-b428-f6620f3596fe...
-2024-12-14 01:12:17,528 - INFO - number of supporting files: 1
-2024-12-14 01:12:17,528 - INFO - supporting data file UUID: 4854c3ff-b3ce-462b-ab8e-0b132cd880d0.
-2024-12-14 01:12:17,528 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz.
-2024-12-14 01:12:17,528 - INFO - assuming fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz is an FCIDUMP file.
-2024-12-14 01:12:17,528 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz...
-2024-12-14 01:12:17,534 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:18,165 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:18,183 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:19,087 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:24,082 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 01:12:24,082 - INFO - Analyzing task d3bcc63c-57ad-4346-8290-e36447186440...
-2024-12-14 01:12:24,082 - INFO - number of supporting files: 1
-2024-12-14 01:12:24,082 - INFO - supporting data file UUID: 379a0693-4ac3-4ff0-be33-7be3f6cad84f.
-2024-12-14 01:12:24,082 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz.
-2024-12-14 01:12:24,082 - INFO - assuming fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz is an FCIDUMP file.
-2024-12-14 01:12:24,082 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz...
-2024-12-14 01:12:24,087 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:24,713 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:24,731 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:24,931 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:26,602 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 01:12:26,602 - INFO - Analyzing task 41907f9f-923d-49e3-80a9-519962110ae7...
-2024-12-14 01:12:26,602 - INFO - number of supporting files: 1
-2024-12-14 01:12:26,602 - INFO - supporting data file UUID: 22ab7092-61bb-401f-ac43-912ec10ea48b.
-2024-12-14 01:12:26,602 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz.
-2024-12-14 01:12:26,602 - INFO - assuming fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz is an FCIDUMP file.
-2024-12-14 01:12:26,602 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz...
-2024-12-14 01:12:26,607 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:27,254 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:27,271 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:27,996 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:30,721 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 01:12:30,721 - INFO - Analyzing task ad9ceeaf-d7be-46b7-95a9-15bfd33f5022...
-2024-12-14 01:12:30,721 - INFO - number of supporting files: 1
-2024-12-14 01:12:30,721 - INFO - supporting data file UUID: 8a8780b0-a0ba-4b7e-9847-589302123e86.
-2024-12-14 01:12:30,721 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz.
-2024-12-14 01:12:30,721 - INFO - assuming fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz is an FCIDUMP file.
-2024-12-14 01:12:30,721 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz...
-2024-12-14 01:12:30,726 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:31,383 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:31,397 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:31,936 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:36,198 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 01:12:36,198 - INFO - Analyzing task adecdd92-73c7-416d-90da-b7a3da7ed50b...
-2024-12-14 01:12:36,198 - INFO - number of supporting files: 1
-2024-12-14 01:12:36,198 - INFO - supporting data file UUID: e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.
-2024-12-14 01:12:36,199 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz.
-2024-12-14 01:12:36,199 - INFO - assuming fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz is an FCIDUMP file.
-2024-12-14 01:12:36,199 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz...
-2024-12-14 01:12:36,204 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:36,847 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:36,862 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:37,052 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:38,675 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 01:12:38,675 - INFO - Analyzing task 03c70feb-49b8-4113-831a-05e3ae55c66b...
-2024-12-14 01:12:38,675 - INFO - number of supporting files: 1
-2024-12-14 01:12:38,676 - INFO - supporting data file UUID: eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.
-2024-12-14 01:12:38,676 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz.
-2024-12-14 01:12:38,676 - INFO - assuming fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz is an FCIDUMP file.
-2024-12-14 01:12:38,676 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz...
-2024-12-14 01:12:38,681 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:39,343 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:39,358 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:39,886 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:42,583 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 01:12:42,584 - INFO - Analyzing task 0e936335-6370-4587-92f0-02eafaf650ed...
-2024-12-14 01:12:42,584 - INFO - number of supporting files: 1
-2024-12-14 01:12:42,584 - INFO - supporting data file UUID: 5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.
-2024-12-14 01:12:42,584 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz.
-2024-12-14 01:12:42,584 - INFO - assuming fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz is an FCIDUMP file.
-2024-12-14 01:12:42,584 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz...
-2024-12-14 01:12:42,589 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:43,074 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:43,089 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:43,913 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:47,384 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 01:12:47,386 - INFO - parsing ../problem_instances/problem_instance.Fe_1.33c9a058-7a67-454c-856c-2519ba55b44d.json
-2024-12-14 01:12:47,387 - INFO - problem_instance UUID: 33c9a058-7a67-454c-856c-2519ba55b44d
-2024-12-14 01:12:47,387 - INFO - problem_instance short name: Fe_1
-2024-12-14 01:12:47,387 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:12:47,402 - INFO - Analyzing task a7e26b10-bd6b-457c-978e-9050f6529007...
-2024-12-14 01:12:47,402 - INFO - number of supporting files: 2
-2024-12-14 01:12:47,402 - INFO - supporting data file UUID: b57e3b82-2511-4c00-a850-f6aeba98b0b2.
-2024-12-14 01:12:47,402 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz.
-2024-12-14 01:12:47,403 - INFO - assuming fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz is an FCIDUMP file.
-2024-12-14 01:12:47,403 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz...
-2024-12-14 01:12:47,408 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:47,974 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:47,989 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:48,663 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:52,451 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 01:12:52,451 - INFO - supporting data file UUID: eaab709a-c628-4295-85d0-412071d1d7cc.
-2024-12-14 01:12:52,451 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe1_vdz.eaab709a-c628-4295-85d0-412071d1d7cc.chk.
-2024-12-14 01:12:52,451 - INFO - assuming Fe1_vdz.eaab709a-c628-4295-85d0-412071d1d7cc.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:12:52,451 - INFO - Analyzing task 6ab8d16c-b8f3-4780-b278-dad81646ca8c...
-2024-12-14 01:12:52,451 - INFO - number of supporting files: 2
-2024-12-14 01:12:52,451 - INFO - supporting data file UUID: b9615d62-11ee-49f7-8df4-df94466b2211.
-2024-12-14 01:12:52,451 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz.
-2024-12-14 01:12:52,451 - INFO - assuming fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz is an FCIDUMP file.
-2024-12-14 01:12:52,451 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz...
-2024-12-14 01:12:52,456 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:53,083 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:53,097 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:13:03,672 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:13:18,736 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 01:13:18,736 - INFO - supporting data file UUID: 7421b0eb-3b7f-42d6-ae6b-6583666b38e2.
-2024-12-14 01:13:18,736 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe1_vtz.7421b0eb-3b7f-42d6-ae6b-6583666b38e2.chk.
-2024-12-14 01:13:18,737 - INFO - assuming Fe1_vtz.7421b0eb-3b7f-42d6-ae6b-6583666b38e2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:13:18,742 - INFO - parsing ../problem_instances/problem_instance.ScO_0.7437abf0-1394-47ce-9218-d181f1732112.json
-2024-12-14 01:13:18,743 - INFO - problem_instance UUID: 7437abf0-1394-47ce-9218-d181f1732112
-2024-12-14 01:13:18,743 - INFO - problem_instance short name: ScO_0
-2024-12-14 01:13:18,743 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 01:13:18,759 - INFO - Analyzing task 9fa4fc3a-b0b9-4eaa-99ee-0469ae5a511d...
-2024-12-14 01:13:18,759 - INFO - number of supporting files: 2
-2024-12-14 01:13:18,759 - INFO - supporting data file UUID: 987498ce-5b91-4df6-924c-82d4841c17c2.
-2024-12-14 01:13:18,759 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz.
-2024-12-14 01:13:18,759 - INFO - assuming fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz is an FCIDUMP file.
-2024-12-14 01:13:18,759 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz...
-2024-12-14 01:13:18,765 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:13:19,419 - INFO - Authentication (publickey) successful!
-2024-12-14 01:13:19,433 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:13:24,595 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:13:36,798 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 01:13:36,798 - INFO - supporting data file UUID: 249d53eb-a925-4b2b-92eb-5a7b05c39069.
-2024-12-14 01:13:36,798 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/ScO_vdz.249d53eb-a925-4b2b-92eb-5a7b05c39069.chk.
-2024-12-14 01:13:36,799 - INFO - assuming ScO_vdz.249d53eb-a925-4b2b-92eb-5a7b05c39069.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:13:36,800 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0003.a37c86c0-1937-4f05-83ab-08a5fd104b7e.json
-2024-12-14 01:13:36,834 - INFO - problem_instance UUID: a37c86c0-1937-4f05-83ab-08a5fd104b7e
-2024-12-14 01:13:36,834 - INFO - problem_instance short name: planted_solution_0003
-2024-12-14 01:13:36,834 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 01:13:36,854 - INFO - Analyzing task 472bbfb1-c081-4df6-b966-32ce1194ab8c...
-2024-12-14 01:13:36,855 - INFO - number of supporting files: 1
-2024-12-14 01:13:36,855 - INFO - supporting data file UUID: efddd28a-383d-4929-9335-22e54ba2ffbe.
-2024-12-14 01:13:36,855 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz.
-2024-12-14 01:13:36,855 - INFO - assuming fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz is an FCIDUMP file.
-2024-12-14 01:13:36,855 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz...
-2024-12-14 01:13:36,860 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:13:37,500 - INFO - Authentication (publickey) successful!
-2024-12-14 01:13:37,520 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:13:37,596 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:13:37,972 - INFO - ===============================================
-2024-12-14 01:13:37,973 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 01:16:41,992 - INFO - Circuit initialization time: 184.019565 seconds.
-2024-12-14 01:16:41,992 - INFO - Estimating logical resources...
-2024-12-14 01:16:48,906 - INFO - Resource estimation time (seconds): 6.913784
-2024-12-14 01:16:48,908 - INFO - parsing ../problem_instances/problem_instance.h_c_n_0.8846a90e-96cb-4bc3-ad06-5388212f728e.json
-2024-12-14 01:16:48,909 - INFO - problem_instance UUID: 8846a90e-96cb-4bc3-ad06-5388212f728e
-2024-12-14 01:16:48,909 - INFO - problem_instance short name: h_c_n_0
-2024-12-14 01:16:48,909 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:16:48,924 - INFO - Analyzing task 94db0c2c-89f6-4c3d-b886-a3a6a2bdad1d...
-2024-12-14 01:16:48,924 - INFO - number of supporting files: 2
-2024-12-14 01:16:48,924 - INFO - supporting data file UUID: 8ab023ed-7cdf-49e6-87d9-369a13f2ac82.
-2024-12-14 01:16:48,924 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz.
-2024-12-14 01:16:48,924 - INFO - assuming fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz is an FCIDUMP file.
-2024-12-14 01:16:48,924 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz...
-2024-12-14 01:16:48,931 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:16:49,437 - INFO - Authentication (publickey) successful!
-2024-12-14 01:16:49,454 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:16:49,570 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:16:50,089 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 01:16:50,090 - INFO - supporting data file UUID: 46053168-a236-4e18-a305-965bdce3e019.
-2024-12-14 01:16:50,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_c_n_cc-pVDZ.46053168-a236-4e18-a305-965bdce3e019.chk.
-2024-12-14 01:16:50,090 - INFO - assuming h_c_n_cc-pVDZ.46053168-a236-4e18-a305-965bdce3e019.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:16:50,090 - INFO - Analyzing task c5ef4702-fc8d-4168-b594-8d5872fdb523...
-2024-12-14 01:16:50,090 - INFO - number of supporting files: 2
-2024-12-14 01:16:50,090 - INFO - supporting data file UUID: 6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.
-2024-12-14 01:16:50,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz.
-2024-12-14 01:16:50,090 - INFO - assuming fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz is an FCIDUMP file.
-2024-12-14 01:16:50,090 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz...
-2024-12-14 01:16:50,095 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:16:50,597 - INFO - Authentication (publickey) successful!
-2024-12-14 01:16:50,617 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:16:54,989 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:17:04,833 - INFO - Skipping Logical Resource Estimate because number of orbitals (74) exceeds maximum specified in config (32).
-2024-12-14 01:17:04,834 - INFO - supporting data file UUID: 6e127086-f92c-4ff5-ab61-7999670be0e7.
-2024-12-14 01:17:04,834 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_c_n_cc-pVTZ.6e127086-f92c-4ff5-ab61-7999670be0e7.chk.
-2024-12-14 01:17:04,834 - INFO - assuming h_c_n_cc-pVTZ.6e127086-f92c-4ff5-ab61-7999670be0e7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:17:04,836 - INFO - parsing ../problem_instances/problem_instance.si_h4_0.13c7144d-047e-4431-8d02-0b1d14c0526b.json
-2024-12-14 01:17:04,836 - INFO - problem_instance UUID: 13c7144d-047e-4431-8d02-0b1d14c0526b
-2024-12-14 01:17:04,837 - INFO - problem_instance short name: si_h4_0
-2024-12-14 01:17:04,837 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:17:04,852 - INFO - Analyzing task 2eaee11d-c1a0-4d2b-b29b-a38e658572f2...
-2024-12-14 01:17:04,852 - INFO - number of supporting files: 2
-2024-12-14 01:17:04,852 - INFO - supporting data file UUID: c37edb04-5163-4d5c-a54e-df5887f0d82e.
-2024-12-14 01:17:04,852 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz.
-2024-12-14 01:17:04,853 - INFO - assuming fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz is an FCIDUMP file.
-2024-12-14 01:17:04,853 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz...
-2024-12-14 01:17:04,866 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:17:05,528 - INFO - Authentication (publickey) successful!
-2024-12-14 01:17:05,544 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:17:05,774 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:17:07,087 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 01:17:07,087 - INFO - supporting data file UUID: de9aba1e-5c4d-4372-8895-d1495c7af8fa.
-2024-12-14 01:17:07,087 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h4_cc-pVDZ.de9aba1e-5c4d-4372-8895-d1495c7af8fa.chk.
-2024-12-14 01:17:07,087 - INFO - assuming si_h4_cc-pVDZ.de9aba1e-5c4d-4372-8895-d1495c7af8fa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:17:07,087 - INFO - Analyzing task 6ca72d49-425b-43f3-96e7-4067bacd0596...
-2024-12-14 01:17:07,087 - INFO - number of supporting files: 2
-2024-12-14 01:17:07,087 - INFO - supporting data file UUID: e709c0b6-d851-47d2-b72a-f4da8479a772.
-2024-12-14 01:17:07,088 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz.
-2024-12-14 01:17:07,088 - INFO - assuming fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz is an FCIDUMP file.
-2024-12-14 01:17:07,088 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz...
-2024-12-14 01:17:07,092 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:17:07,730 - INFO - Authentication (publickey) successful!
-2024-12-14 01:17:07,747 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:18:46,133 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:19:38,350 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 01:19:38,350 - INFO - supporting data file UUID: 10435f0a-a736-4c87-957b-f7a1183b2eca.
-2024-12-14 01:19:38,350 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h4_cc-pVTZ.10435f0a-a736-4c87-957b-f7a1183b2eca.chk.
-2024-12-14 01:19:38,350 - INFO - assuming si_h4_cc-pVTZ.10435f0a-a736-4c87-957b-f7a1183b2eca.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:19:38,354 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0009.8db449b1-265b-4a66-b965-a2b4833a88d1.json
-2024-12-14 01:19:38,356 - INFO - problem_instance UUID: 8db449b1-265b-4a66-b965-a2b4833a88d1
-2024-12-14 01:19:38,356 - INFO - problem_instance short name: planted_solution_0009
-2024-12-14 01:19:38,356 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 01:19:38,367 - INFO - Analyzing task 8f373cb0-952d-48c6-a871-8a10e52e7c19...
-2024-12-14 01:19:38,367 - INFO - number of supporting files: 1
-2024-12-14 01:19:38,367 - INFO - supporting data file UUID: bbbbba1c-868c-45a5-b16c-0c17536e83d8.
-2024-12-14 01:19:38,367 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz.
-2024-12-14 01:19:38,367 - INFO - assuming fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz is an FCIDUMP file.
-2024-12-14 01:19:38,367 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz...
-2024-12-14 01:19:38,372 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:19:39,033 - INFO - Authentication (publickey) successful!
-2024-12-14 01:19:39,050 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:19:42,018 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:19:50,608 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 01:19:50,609 - INFO - parsing ../problem_instances/problem_instance.Mn_1.11c8be98-d9c9-40ea-8d88-ea8c555028f6.json
-2024-12-14 01:19:50,610 - INFO - problem_instance UUID: 11c8be98-d9c9-40ea-8d88-ea8c555028f6
-2024-12-14 01:19:50,610 - INFO - problem_instance short name: Mn_1
-2024-12-14 01:19:50,610 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:19:50,625 - INFO - Analyzing task 9d82f7d4-165d-4499-8add-361a770d1d44...
-2024-12-14 01:19:50,625 - INFO - number of supporting files: 2
-2024-12-14 01:19:50,625 - INFO - supporting data file UUID: 51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.
-2024-12-14 01:19:50,625 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz.
-2024-12-14 01:19:50,625 - INFO - assuming fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz is an FCIDUMP file.
-2024-12-14 01:19:50,625 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz...
-2024-12-14 01:19:50,634 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:19:51,275 - INFO - Authentication (publickey) successful!
-2024-12-14 01:19:51,290 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:19:51,918 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:19:55,600 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 01:19:55,600 - INFO - supporting data file UUID: d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.
-2024-12-14 01:19:55,600 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn1_vdz.d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.chk.
-2024-12-14 01:19:55,600 - INFO - assuming Mn1_vdz.d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:19:55,601 - INFO - Analyzing task 29eecba9-3d4d-4672-8b19-475f53b2f1be...
-2024-12-14 01:19:55,601 - INFO - number of supporting files: 2
-2024-12-14 01:19:55,601 - INFO - supporting data file UUID: 00c757c4-3c99-4521-82b1-3e3a12d49854.
-2024-12-14 01:19:55,601 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz.
-2024-12-14 01:19:55,601 - INFO - assuming fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz is an FCIDUMP file.
-2024-12-14 01:19:55,601 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz...
-2024-12-14 01:19:55,606 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:19:56,269 - INFO - Authentication (publickey) successful!
-2024-12-14 01:19:56,285 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:20:21,952 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:20:41,886 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 01:20:41,886 - INFO - supporting data file UUID: e4481467-4b06-43b0-9e22-b3c5fa930709.
-2024-12-14 01:20:41,886 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn1_vtz.e4481467-4b06-43b0-9e22-b3c5fa930709.chk.
-2024-12-14 01:20:41,886 - INFO - assuming Mn1_vtz.e4481467-4b06-43b0-9e22-b3c5fa930709.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:20:41,892 - INFO - parsing ../problem_instances/problem_instance.c_h3_cl_0.379781b8-5732-492e-9fca-6fad3fc3692a.json
-2024-12-14 01:20:41,892 - INFO - problem_instance UUID: 379781b8-5732-492e-9fca-6fad3fc3692a
-2024-12-14 01:20:41,892 - INFO - problem_instance short name: c_h3_cl_0
-2024-12-14 01:20:41,892 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:20:41,903 - INFO - Analyzing task 0667179a-19eb-44b9-a544-dae8793fdc3f...
-2024-12-14 01:20:41,903 - INFO - number of supporting files: 2
-2024-12-14 01:20:41,903 - INFO - supporting data file UUID: 80298b55-8915-462f-8f20-e4332c94ed41.
-2024-12-14 01:20:41,903 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz.
-2024-12-14 01:20:41,903 - INFO - assuming fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz is an FCIDUMP file.
-2024-12-14 01:20:41,903 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz...
-2024-12-14 01:20:41,909 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:20:42,557 - INFO - Authentication (publickey) successful!
-2024-12-14 01:20:42,572 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:20:43,407 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:20:47,558 - INFO - Skipping Logical Resource Estimate because number of orbitals (47) exceeds maximum specified in config (32).
-2024-12-14 01:20:47,558 - INFO - supporting data file UUID: a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.
-2024-12-14 01:20:47,558 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h3_cl_cc-pVDZ.a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.chk.
-2024-12-14 01:20:47,558 - INFO - assuming c_h3_cl_cc-pVDZ.a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:20:47,558 - INFO - Analyzing task ae315bef-f3c6-4c84-93c5-0d8ab510ece3...
-2024-12-14 01:20:47,558 - INFO - number of supporting files: 2
-2024-12-14 01:20:47,558 - INFO - supporting data file UUID: a53ae008-4ad2-4736-9a57-cfc011e3aace.
-2024-12-14 01:20:47,558 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz.
-2024-12-14 01:20:47,558 - INFO - assuming fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz is an FCIDUMP file.
-2024-12-14 01:20:47,558 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz...
-2024-12-14 01:20:47,564 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:20:48,227 - INFO - Authentication (publickey) successful!
-2024-12-14 01:20:48,242 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:20:52,967 - ERROR - Socket exception: Connection reset by peer (104)
-2024-12-14 01:20:52,968 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:38:56,164 - INFO - ===============================================
-2024-12-14 13:38:56,164 - INFO - overall start time: 2024-12-14 13:38:56.164564
-2024-12-14 13:38:56,164 - INFO - input directory: ../problem_instances/
-2024-12-14 13:38:56,165 - INFO - parsing 82 files in the input directory
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.cl2_0.0e393c20-3915-42b9-a8aa-29bf53548269.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Cu_0.1448d27d-bfa9-470f-a6c8-864a295b66f4.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.si2_h6_0.0c1dfb55-f021-409a-80b1-79c8c2908095.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.blue_dimer.dc8bdc56-5ebd-4996-6b81-81b1a06d8c76.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.benzene.f377cc27-366a-45af-b45a-c8478e4b6199.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Cr_1.02a8c4e9-9d15-4742-b4cc-7f47f69da0e5.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Ti_1.9823b0dd-87b6-4793-9741-e8cbcf2b50c0.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.V_0.a14a1e28-71c5-4e23-bf6e-dd9662a6df58.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.CuO_0.886ad5bf-d487-48c8-b08c-c9f82b84ed5d.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.TiO_0.0b91f99e-8de5-415d-a78e-f80e45d621ca.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.na2_0.edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.mn_mono.cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.FeO_0.55d0ed82-0560-4448-8459-c2ba00654d9d.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.p_h3_0.0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.h2_s_0.208f2e50-2b56-4e72-815a-cba5cec1264c.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Sc_0.67f72316-2262-44fb-8c0a-e159e1cd0cf0.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.na_cl_0.3f141f05-532b-478d-b38a-2ae07baadc88.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.c2_h2_0.0ca102a7-dad4-4d42-8c73-9acfa45378d7.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.li_f_0.e48e7467-1fcd-478b-a599-f4ce881c57b9.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.h2_c_o_0.25fd617b-8e7f-4422-9e97-cc3f6b0d3876.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.planted_solution_0011.766ba2da-e72a-4e03-a739-f97269026fc4.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Mn_0.bc202949-d76c-4962-b937-5c12b298b8b4.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.planted_solution_0008.b57eb979-5c09-4974-97b4-5862e109a1ae.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.mo_n2.664ec8e4-09d5-41cc-6266-ddb26219366f.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.li_h_0.6d355019-13aa-41fc-a530-31d5f968ba22.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.li2_0.3301a356-21a9-472b-8021-f02f4d2c9eec.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.h_f_0.892e3341-7186-44c6-9a1a-20f270ddc8b8.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.Fe_0.05abb33d-ecea-406f-8832-31a814b26dfd.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.planted_solution_0010.bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.ru_macho.b78a10f2-ce8a-43c0-69ec-4cf666d8e85c.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.Cu_1.d5c7ab73-dfc1-499e-9027-601476004107.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.n_h3_0.127cfea5-8a7d-45a0-9012-949816a0b8d9.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.planted_solution_0006.42958a3e-8b35-4992-acd8-6711848066c1.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.n2_h4_0.f1a6b508-75e8-4afb-9c81-fc61af11b523.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.c2_h4_0.9fbd9b4c-5ea9-4095-af7b-7d4491399e42.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.O_1.d712afaf-6ec4-42d9-b5fd-1edee3ec1046.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.cr_dimer.8ed1a800-a4c6-4bff-a6de-cb220554c42f.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.be_0.19cada59-64cc-466c-8809-782a4f574dcc.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.f2_0.e3e78b41-577d-4536-a63f-7e968eeb6493.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.n2_0.9bd9cde6-6daa-441a-984e-ae1c1c051e91.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.fe_red.a8895776-3583-4884-fbc7-d6f9df21a7ac.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.Fe_1.33c9a058-7a67-454c-856c-2519ba55b44d.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.ScO_0.7437abf0-1394-47ce-9218-d181f1732112.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.planted_solution_0003.a37c86c0-1937-4f05-83ab-08a5fd104b7e.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.h_c_n_0.8846a90e-96cb-4bc3-ad06-5388212f728e.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.si_h4_0.13c7144d-047e-4431-8d02-0b1d14c0526b.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.planted_solution_0009.8db449b1-265b-4a66-b965-a2b4833a88d1.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.Mn_1.11c8be98-d9c9-40ea-8d88-ea8c555028f6.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.c_h3_cl_0.379781b8-5732-492e-9fca-6fad3fc3692a.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.p2_0.2e61ba35-b6b0-42b5-b3e8-d25bd83145ba.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.si_o_0.68f1a091-8652-4095-ba31-56f0e02e27d3.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h2_o_0.9b8083ab-ea59-47db-894c-95a0d2ba3cb6.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h_o_cl_0.ea2e13c5-6d80-466e-bd6b-6289e10ed82b.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c2_h6_0.b1c5ac4e-9b94-4e89-9557-da2026933172.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.planted_solution_0001.3d3b9e8a-7842-4ca1-bd82-eddb9804972d.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c_h4_0.e0f6ed02-6502-454b-bf2c-e7994e0510f4.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.V_1.18e1973e-d6cf-48d6-9ca4-c1af21ff7c98.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.planted_solution_0007.3aaf0bb4-b412-4746-922a-c380b4024d00.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.Ti_0.c1e4c7dd-2dc4-4dd0-889d-fb34f602965a.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.CrO_0.2140edd4-8eb3-4270-b753-278334998e3d.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.planted_solution_0002.00043d56-ed63-4266-907c-99c95c51b9db.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h3_c_o_h_0.5524b5e5-adba-4322-9808-69e75e4335b2.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.Cr_0.b8fe08a4-82fe-4636-9812-b1e0666f95b5.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h2_o2_0.cc7044d7-28e0-4fe2-bd6b-c9c758da4776.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c_o_0.1c3155e0-3679-4eff-bed0-57a1082672c3.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.si_h2_singlet_0.a0a07bfe-aac2-4d61-9425-009953899b3b.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c_s_0.f90280cc-c860-4ff1-a9ec-4841cec989f7.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h3_c_s_h_0.674b572a-3d6d-4418-8cc2-4755d90367ee.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h_cl_0.586ce6a9-1876-459e-9b6c-be8bb1c4d1a5.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.s_o2_0.1d0b8322-24b3-407a-8246-07444bb020be.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.planted_solution_0004.e0adafc5-789e-43e6-8f9e-e718da28de3a.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.O_0.162f41da-af43-427c-a8bc-ae9fa97ace95.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.ozone.9560107e-f1ad-4480-aa51-ef03edda6e19.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c_h2_singlet_0.7ca1486c-06a5-47c1-b8ab-eab491ffc68b.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.VO_0.bcc86483-2a7e-4271-b6fc-238ef5e682f6.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.planted_solution_0005.7e0fb928-b0a9-4b44-89f1-7e0ee3b2bb13.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.ru_mono.7213642b-5f16-48be-d5e5-2bc42ebb8526.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.mo2_n2.90d4e4fc-1216-4846-b45f-198c0530e29b.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.MnO_0.e2212cdf-adef-454a-b218-05041d723c55.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.mo_n2_pincer.8a3787cc-d3d0-42a8-d9a9-7de2aed45208.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.c_o2_0.3987b2dd-25bc-44e2-b516-dbc3f670a9c3.json
-2024-12-14 13:38:56,168 - INFO - parsing ../problem_instances/problem_instance.cl2_0.0e393c20-3915-42b9-a8aa-29bf53548269.json
-2024-12-14 13:38:56,168 - INFO - problem_instance UUID: 0e393c20-3915-42b9-a8aa-29bf53548269
-2024-12-14 13:38:56,168 - INFO - problem_instance short name: cl2_0
-2024-12-14 13:38:56,168 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 13:38:56,184 - INFO - Analyzing task c01649e2-8c5c-4827-a037-1ede2159e558...
-2024-12-14 13:38:56,184 - INFO - number of supporting files: 2
-2024-12-14 13:38:56,185 - INFO - supporting data file UUID: 8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.
-2024-12-14 13:38:56,185 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz.
-2024-12-14 13:38:56,185 - INFO - assuming fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz is an FCIDUMP file.
-2024-12-14 13:38:56,185 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz...
-2024-12-14 13:38:56,192 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:38:56,675 - INFO - Authentication (publickey) successful!
-2024-12-14 13:38:56,699 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:38:56,875 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:38:57,722 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 13:38:57,722 - INFO - supporting data file UUID: 5277b7f4-854c-45a4-a98e-95db9b40c071.
-2024-12-14 13:38:57,723 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVDZ.5277b7f4-854c-45a4-a98e-95db9b40c071.chk.
-2024-12-14 13:38:57,723 - INFO - assuming cl2_cc-pVDZ.5277b7f4-854c-45a4-a98e-95db9b40c071.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:38:57,723 - INFO - Analyzing task 214bb702-d7bc-4141-8cf3-f6979ba0f67a...
-2024-12-14 13:38:57,723 - INFO - number of supporting files: 2
-2024-12-14 13:38:57,723 - INFO - supporting data file UUID: 7b8c2dbd-8966-4eb4-83af-8acb07454e8a.
-2024-12-14 13:38:57,723 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz.
-2024-12-14 13:38:57,723 - INFO - assuming fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz is an FCIDUMP file.
-2024-12-14 13:38:57,723 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz...
-2024-12-14 13:38:57,728 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:38:58,380 - INFO - Authentication (publickey) successful!
-2024-12-14 13:38:58,398 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:42:33,117 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:43:50,469 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 13:43:50,469 - INFO - supporting data file UUID: dba5899f-164d-4e94-85f7-a1d8757179ab.
-2024-12-14 13:43:50,469 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVQZ.dba5899f-164d-4e94-85f7-a1d8757179ab.chk.
-2024-12-14 13:43:50,469 - INFO - assuming cl2_cc-pVQZ.dba5899f-164d-4e94-85f7-a1d8757179ab.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:43:50,469 - INFO - Analyzing task 35e4c771-0f4f-4413-b42f-132f1e606cb0...
-2024-12-14 13:43:50,469 - INFO - number of supporting files: 2
-2024-12-14 13:43:50,469 - INFO - supporting data file UUID: 781d0704-7a95-4183-9c50-cbdbd976884a.
-2024-12-14 13:43:50,469 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz.
-2024-12-14 13:43:50,469 - INFO - assuming fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz is an FCIDUMP file.
-2024-12-14 13:43:50,469 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz...
-2024-12-14 13:43:50,475 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:43:51,147 - INFO - Authentication (publickey) successful!
-2024-12-14 13:43:51,165 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:43:55,059 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:44:04,546 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 13:44:04,546 - INFO - supporting data file UUID: 27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.
-2024-12-14 13:44:04,547 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVTZ.27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.chk.
-2024-12-14 13:44:04,547 - INFO - assuming cl2_cc-pVTZ.27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:44:04,549 - INFO - parsing ../problem_instances/problem_instance.Cu_0.1448d27d-bfa9-470f-a6c8-864a295b66f4.json
-2024-12-14 13:44:04,549 - INFO - problem_instance UUID: 1448d27d-bfa9-470f-a6c8-864a295b66f4
-2024-12-14 13:44:04,549 - INFO - problem_instance short name: Cu_0
-2024-12-14 13:44:04,550 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 13:44:04,568 - INFO - Analyzing task 7f0518e8-e2c8-4912-8268-4de4cd504084...
-2024-12-14 13:44:04,568 - INFO - number of supporting files: 2
-2024-12-14 13:44:04,568 - INFO - supporting data file UUID: 48434e2f-f09e-474e-b98c-af180386a258.
-2024-12-14 13:44:04,568 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz.
-2024-12-14 13:44:04,568 - INFO - assuming fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz is an FCIDUMP file.
-2024-12-14 13:44:04,568 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz...
-2024-12-14 13:44:04,573 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:44:05,238 - INFO - Authentication (publickey) successful!
-2024-12-14 13:44:05,255 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:44:05,872 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:44:09,489 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 13:44:09,489 - INFO - supporting data file UUID: 08885387-3319-4489-9487-56a333abf06b.
-2024-12-14 13:44:09,489 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu0_vdz.08885387-3319-4489-9487-56a333abf06b.chk.
-2024-12-14 13:44:09,489 - INFO - assuming Cu0_vdz.08885387-3319-4489-9487-56a333abf06b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:44:09,489 - INFO - Analyzing task 0f5171c4-cf55-4a82-99a2-c72edebce9c9...
-2024-12-14 13:44:09,489 - INFO - number of supporting files: 2
-2024-12-14 13:44:09,489 - INFO - supporting data file UUID: e304b6b5-b820-470d-a8b5-92d6354abd16.
-2024-12-14 13:44:09,489 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz.
-2024-12-14 13:44:09,489 - INFO - assuming fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz is an FCIDUMP file.
-2024-12-14 13:44:09,489 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz...
-2024-12-14 13:44:09,493 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:44:10,135 - INFO - Authentication (publickey) successful!
-2024-12-14 13:44:10,149 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:44:31,130 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:44:55,932 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 13:44:55,932 - INFO - supporting data file UUID: 34a02644-d0a3-4e3b-987c-c7962587f41a.
-2024-12-14 13:44:55,932 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu0_vtz.34a02644-d0a3-4e3b-987c-c7962587f41a.chk.
-2024-12-14 13:44:55,932 - INFO - assuming Cu0_vtz.34a02644-d0a3-4e3b-987c-c7962587f41a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:44:55,937 - INFO - parsing ../problem_instances/problem_instance.si2_h6_0.0c1dfb55-f021-409a-80b1-79c8c2908095.json
-2024-12-14 13:44:55,937 - INFO - problem_instance UUID: 0c1dfb55-f021-409a-80b1-79c8c2908095
-2024-12-14 13:44:55,938 - INFO - problem_instance short name: si2_h6_0
-2024-12-14 13:44:55,938 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 13:44:55,953 - INFO - Analyzing task 109f95c5-8561-458c-8f41-72be596b87e6...
-2024-12-14 13:44:55,953 - INFO - number of supporting files: 2
-2024-12-14 13:44:55,953 - INFO - supporting data file UUID: bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.
-2024-12-14 13:44:55,953 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz.
-2024-12-14 13:44:55,953 - INFO - assuming fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz is an FCIDUMP file.
-2024-12-14 13:44:55,953 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz...
-2024-12-14 13:44:55,958 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:44:56,618 - INFO - Authentication (publickey) successful!
-2024-12-14 13:44:56,636 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:45:04,175 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:45:16,444 - INFO - Skipping Logical Resource Estimate because number of orbitals (66) exceeds maximum specified in config (32).
-2024-12-14 13:45:16,445 - INFO - supporting data file UUID: 6494dcb3-de3a-4bd2-bd92-a121241b95aa.
-2024-12-14 13:45:16,445 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si2_h6_cc-pVDZ.6494dcb3-de3a-4bd2-bd92-a121241b95aa.chk.
-2024-12-14 13:45:16,445 - INFO - assuming si2_h6_cc-pVDZ.6494dcb3-de3a-4bd2-bd92-a121241b95aa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:45:16,446 - INFO - parsing ../problem_instances/problem_instance.blue_dimer.dc8bdc56-5ebd-4996-6b81-81b1a06d8c76.json
-2024-12-14 13:45:16,447 - INFO - problem_instance UUID: dc8bdc56-5ebd-4996-6b81-81b1a06d8c76
-2024-12-14 13:45:16,447 - INFO - problem_instance short name: blue_dimer
-2024-12-14 13:45:16,447 - INFO - contains 12 associated Hamiltonians.
-2024-12-14 13:45:16,462 - INFO - Analyzing task 9da97ef6-4bad-4c82-8576-9b8e539a7ba8...
-2024-12-14 13:45:16,462 - INFO - number of supporting files: 1
-2024-12-14 13:45:16,462 - INFO - supporting data file UUID: 46967cfc-d867-40e8-bef0-9655c46cef29.
-2024-12-14 13:45:16,462 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz.
-2024-12-14 13:45:16,463 - INFO - assuming fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz is an FCIDUMP file.
-2024-12-14 13:45:16,463 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz...
-2024-12-14 13:45:16,467 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:45:17,122 - INFO - Authentication (publickey) successful!
-2024-12-14 13:45:17,138 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:45:17,242 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:45:17,277 - INFO - ===============================================
-2024-12-14 13:45:17,277 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 13:46:10,685 - INFO - Circuit initialization time: 53.407307 seconds.
-2024-12-14 13:46:10,685 - INFO - Estimating logical resources...
-2024-12-14 13:46:20,196 - INFO - Resource estimation time (seconds): 9.510511
-2024-12-14 13:46:20,196 - INFO - Analyzing task f20db1b1-86e3-4ddf-96ff-a6d37f331935...
-2024-12-14 13:46:20,196 - INFO - number of supporting files: 1
-2024-12-14 13:46:20,196 - INFO - supporting data file UUID: 85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.
-2024-12-14 13:46:20,196 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz.
-2024-12-14 13:46:20,196 - INFO - assuming fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz is an FCIDUMP file.
-2024-12-14 13:46:20,196 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz...
-2024-12-14 13:46:20,203 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:46:20,880 - INFO - Authentication (publickey) successful!
-2024-12-14 13:46:20,893 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:46:20,952 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:46:21,058 - INFO - ===============================================
-2024-12-14 13:46:21,058 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 13:47:28,924 - INFO - Circuit initialization time: 67.866051 seconds.
-2024-12-14 13:47:28,924 - INFO - Estimating logical resources...
-2024-12-14 13:47:41,045 - INFO - Resource estimation time (seconds): 12.120827
-2024-12-14 13:47:41,045 - INFO - Analyzing task 742be33c-0982-4b06-b324-1d86242e28d9...
-2024-12-14 13:47:41,046 - INFO - number of supporting files: 1
-2024-12-14 13:47:41,046 - INFO - supporting data file UUID: 7db0f859-073f-46af-9325-016a67229a4b.
-2024-12-14 13:47:41,046 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz.
-2024-12-14 13:47:41,046 - INFO - assuming fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz is an FCIDUMP file.
-2024-12-14 13:47:41,046 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz...
-2024-12-14 13:47:41,050 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:47:41,701 - INFO - Authentication (publickey) successful!
-2024-12-14 13:47:41,714 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:47:41,822 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:47:42,404 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 13:47:42,404 - INFO - Analyzing task 3b49563d-948a-4ecb-84a0-d3c0c2c0d217...
-2024-12-14 13:47:42,404 - INFO - number of supporting files: 1
-2024-12-14 13:47:42,404 - INFO - supporting data file UUID: 2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.
-2024-12-14 13:47:42,404 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz.
-2024-12-14 13:47:42,404 - INFO - assuming fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz is an FCIDUMP file.
-2024-12-14 13:47:42,405 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz...
-2024-12-14 13:47:42,410 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:47:43,061 - INFO - Authentication (publickey) successful!
-2024-12-14 13:47:43,079 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:47:43,210 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:47:43,976 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 13:47:43,976 - INFO - Analyzing task 950da653-13ce-4cd7-95d8-5045ab03d4bc...
-2024-12-14 13:47:43,976 - INFO - number of supporting files: 1
-2024-12-14 13:47:43,976 - INFO - supporting data file UUID: a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.
-2024-12-14 13:47:43,976 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz.
-2024-12-14 13:47:43,977 - INFO - assuming fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz is an FCIDUMP file.
-2024-12-14 13:47:43,977 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz...
-2024-12-14 13:47:43,983 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:47:44,636 - INFO - Authentication (publickey) successful!
-2024-12-14 13:47:44,650 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:47:44,702 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:47:44,756 - INFO - ===============================================
-2024-12-14 13:47:44,756 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 13:48:15,189 - INFO - Circuit initialization time: 30.432783 seconds.
-2024-12-14 13:48:15,189 - INFO - Estimating logical resources...
-2024-12-14 13:48:21,642 - INFO - Resource estimation time (seconds): 6.45274
-2024-12-14 13:48:21,642 - INFO - Analyzing task 13821f5c-78a6-485c-9006-a17a234cde9f...
-2024-12-14 13:48:21,642 - INFO - number of supporting files: 1
-2024-12-14 13:48:21,642 - INFO - supporting data file UUID: d9707874-28d5-48b6-824e-a2e6c8753437.
-2024-12-14 13:48:21,642 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz.
-2024-12-14 13:48:21,642 - INFO - assuming fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz is an FCIDUMP file.
-2024-12-14 13:48:21,642 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz...
-2024-12-14 13:48:21,648 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:48:22,307 - INFO - Authentication (publickey) successful!
-2024-12-14 13:48:22,323 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:48:22,378 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:48:22,484 - INFO - ===============================================
-2024-12-14 13:48:22,485 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 13:49:28,556 - INFO - Circuit initialization time: 66.071282 seconds.
-2024-12-14 13:49:28,556 - INFO - Estimating logical resources...
-2024-12-14 13:49:40,676 - INFO - Resource estimation time (seconds): 12.119783
-2024-12-14 13:49:40,676 - INFO - Analyzing task 765594e5-44ac-41a2-89a7-f2ac03536379...
-2024-12-14 13:49:40,676 - INFO - number of supporting files: 1
-2024-12-14 13:49:40,676 - INFO - supporting data file UUID: 727ab190-e399-4bb6-a9b3-20ae57789bac.
-2024-12-14 13:49:40,676 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz.
-2024-12-14 13:49:40,677 - INFO - assuming fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz is an FCIDUMP file.
-2024-12-14 13:49:40,677 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz...
-2024-12-14 13:49:40,690 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:49:41,322 - INFO - Authentication (publickey) successful!
-2024-12-14 13:49:41,342 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:49:41,457 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:49:42,040 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 13:49:42,040 - INFO - Analyzing task 858b9683-fc6c-4ebe-8c33-27f0d848f24f...
-2024-12-14 13:49:42,040 - INFO - number of supporting files: 1
-2024-12-14 13:49:42,041 - INFO - supporting data file UUID: e986eb83-6b9d-439e-85ca-a9b931eef4a2.
-2024-12-14 13:49:42,041 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz.
-2024-12-14 13:49:42,041 - INFO - assuming fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz is an FCIDUMP file.
-2024-12-14 13:49:42,041 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz...
-2024-12-14 13:49:42,047 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:49:42,691 - INFO - Authentication (publickey) successful!
-2024-12-14 13:49:42,707 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:49:42,813 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:49:43,540 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 13:49:43,540 - INFO - Analyzing task 1a013e9f-7eab-4a1b-b486-1d9e2d99e754...
-2024-12-14 13:49:43,540 - INFO - number of supporting files: 1
-2024-12-14 13:49:43,540 - INFO - supporting data file UUID: 6bf3207c-664b-4ed3-8e74-82b42e277234.
-2024-12-14 13:49:43,540 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz.
-2024-12-14 13:49:43,540 - INFO - assuming fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz is an FCIDUMP file.
-2024-12-14 13:49:43,540 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz...
-2024-12-14 13:49:43,545 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:49:44,195 - INFO - Authentication (publickey) successful!
-2024-12-14 13:49:44,212 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:49:44,286 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:49:44,345 - INFO - ===============================================
-2024-12-14 13:49:44,345 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 13:50:21,759 - INFO - Circuit initialization time: 37.413764 seconds.
-2024-12-14 13:50:21,759 - INFO - Estimating logical resources...
-2024-12-14 13:50:29,468 - INFO - Resource estimation time (seconds): 7.70904
-2024-12-14 13:50:29,468 - INFO - Analyzing task 001a0d11-165a-49c5-a334-643023029f40...
-2024-12-14 13:50:29,468 - INFO - number of supporting files: 1
-2024-12-14 13:50:29,468 - INFO - supporting data file UUID: fb3ecfad-6450-423e-aa58-d5cddab6f0f6.
-2024-12-14 13:50:29,468 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz.
-2024-12-14 13:50:29,469 - INFO - assuming fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz is an FCIDUMP file.
-2024-12-14 13:50:29,469 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz...
-2024-12-14 13:50:29,473 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:50:30,127 - INFO - Authentication (publickey) successful!
-2024-12-14 13:50:30,141 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:50:30,206 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:50:30,477 - INFO - ===============================================
-2024-12-14 13:50:30,477 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 13:53:27,004 - INFO - Circuit initialization time: 176.526281 seconds.
-2024-12-14 13:53:27,004 - INFO - Estimating logical resources...
-2024-12-14 13:53:53,909 - INFO - Resource estimation time (seconds): 26.904671
-2024-12-14 13:53:53,909 - INFO - Analyzing task 1c9508e3-b9fe-44f1-ae58-c6339ef43f47...
-2024-12-14 13:53:53,909 - INFO - number of supporting files: 1
-2024-12-14 13:53:53,909 - INFO - supporting data file UUID: dc406285-bac1-4b99-afbf-06728b7d699b.
-2024-12-14 13:53:53,909 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz.
-2024-12-14 13:53:53,909 - INFO - assuming fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz is an FCIDUMP file.
-2024-12-14 13:53:53,909 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz...
-2024-12-14 13:53:53,913 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:53:54,573 - INFO - Authentication (publickey) successful!
-2024-12-14 13:53:54,588 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:53:54,688 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:53:55,274 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 13:53:55,274 - INFO - Analyzing task 6713517a-ab65-4381-aae1-0839dcd6c1a0...
-2024-12-14 13:53:55,274 - INFO - number of supporting files: 1
-2024-12-14 13:53:55,275 - INFO - supporting data file UUID: af9d6a83-7898-4c13-80eb-a83a533ebf2d.
-2024-12-14 13:53:55,275 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz.
-2024-12-14 13:53:55,275 - INFO - assuming fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz is an FCIDUMP file.
-2024-12-14 13:53:55,275 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz...
-2024-12-14 13:53:55,280 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:53:55,933 - INFO - Authentication (publickey) successful!
-2024-12-14 13:53:55,949 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:53:56,064 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:53:56,794 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 13:53:56,796 - INFO - parsing ../problem_instances/problem_instance.benzene.f377cc27-366a-45af-b45a-c8478e4b6199.json
-2024-12-14 13:53:56,796 - INFO - problem_instance UUID: f377cc27-366a-45af-b45a-c8478e4b6199
-2024-12-14 13:53:56,796 - INFO - problem_instance short name: benzene
-2024-12-14 13:53:56,796 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 13:53:56,812 - INFO - Analyzing task b86457a4-abf4-43c9-9c08-2397e95b7c0f...
-2024-12-14 13:53:56,812 - INFO - number of supporting files: 1
-2024-12-14 13:53:56,812 - INFO - supporting data file UUID: 4c655f65-1899-469c-975a-a3caec750697.
-2024-12-14 13:53:56,812 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz.
-2024-12-14 13:53:56,812 - INFO - assuming FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz is an FCIDUMP file.
-2024-12-14 13:53:56,812 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz...
-2024-12-14 13:53:56,818 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:53:57,458 - INFO - Authentication (publickey) successful!
-2024-12-14 13:53:57,472 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:53:57,532 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:53:57,684 - INFO - ===============================================
-2024-12-14 13:53:57,684 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 13:55:49,292 - INFO - Circuit initialization time: 111.608076 seconds.
-2024-12-14 13:55:49,292 - INFO - Estimating logical resources...
-2024-12-14 13:56:13,811 - INFO - Resource estimation time (seconds): 24.51864
-2024-12-14 13:56:13,811 - INFO - Analyzing task 7148b36a-0571-4a41-9239-19a97339f68a...
-2024-12-14 13:56:13,811 - INFO - number of supporting files: 1
-2024-12-14 13:56:13,811 - INFO - supporting data file UUID: 96ff0e22-a3ab-49f3-aee9-9a1886cbf850.
-2024-12-14 13:56:13,811 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz.
-2024-12-14 13:56:13,811 - INFO - assuming FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz is an FCIDUMP file.
-2024-12-14 13:56:13,811 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz...
-2024-12-14 13:56:13,817 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:56:14,505 - INFO - Authentication (publickey) successful!
-2024-12-14 13:56:14,522 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:56:39,301 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:57:04,070 - INFO - Skipping Logical Resource Estimate because number of orbitals (108) exceeds maximum specified in config (32).
-2024-12-14 13:57:04,078 - INFO - parsing ../problem_instances/problem_instance.Cr_1.02a8c4e9-9d15-4742-b4cc-7f47f69da0e5.json
-2024-12-14 13:57:04,079 - INFO - problem_instance UUID: 02a8c4e9-9d15-4742-b4cc-7f47f69da0e5
-2024-12-14 13:57:04,079 - INFO - problem_instance short name: Cr_1
-2024-12-14 13:57:04,079 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 13:57:04,094 - INFO - Analyzing task b24b71b9-971a-4aca-9fc0-7198d16ca9ed...
-2024-12-14 13:57:04,095 - INFO - number of supporting files: 2
-2024-12-14 13:57:04,095 - INFO - supporting data file UUID: 69a1826c-1bee-4855-8f5f-5df29035bfca.
-2024-12-14 13:57:04,095 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz.
-2024-12-14 13:57:04,095 - INFO - assuming fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz is an FCIDUMP file.
-2024-12-14 13:57:04,095 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz...
-2024-12-14 13:57:04,100 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:57:04,745 - INFO - Authentication (publickey) successful!
-2024-12-14 13:57:04,761 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:57:05,125 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:57:07,338 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 13:57:07,338 - INFO - supporting data file UUID: 4ead3f70-392f-45e8-aa0d-f5e364d389d7.
-2024-12-14 13:57:07,338 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vdz.4ead3f70-392f-45e8-aa0d-f5e364d389d7.chk.
-2024-12-14 13:57:07,338 - INFO - assuming Cr1_vdz.4ead3f70-392f-45e8-aa0d-f5e364d389d7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:57:07,338 - INFO - Analyzing task e604a906-55fa-4b3f-bf17-c24a30312b84...
-2024-12-14 13:57:07,338 - INFO - number of supporting files: 2
-2024-12-14 13:57:07,338 - INFO - supporting data file UUID: 4e3649dd-9050-4acc-93f6-a09c962e89d7.
-2024-12-14 13:57:07,338 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz.
-2024-12-14 13:57:07,338 - INFO - assuming fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz is an FCIDUMP file.
-2024-12-14 13:57:07,338 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz...
-2024-12-14 13:57:07,344 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:57:07,982 - INFO - Authentication (publickey) successful!
-2024-12-14 13:57:07,996 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:02:03,689 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:03:35,217 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-14 14:03:35,218 - INFO - supporting data file UUID: ad74c129-2df4-4066-8972-6c0105bc0fa7.
-2024-12-14 14:03:35,218 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vqz.ad74c129-2df4-4066-8972-6c0105bc0fa7.chk.
-2024-12-14 14:03:35,218 - INFO - assuming Cr1_vqz.ad74c129-2df4-4066-8972-6c0105bc0fa7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:03:35,218 - INFO - Analyzing task f4b120e9-acd0-4c7c-89e2-cc082f52f5cf...
-2024-12-14 14:03:35,218 - INFO - number of supporting files: 2
-2024-12-14 14:03:35,218 - INFO - supporting data file UUID: efaceb68-6fae-491a-bb90-1e3e3463f010.
-2024-12-14 14:03:35,218 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz.
-2024-12-14 14:03:35,218 - INFO - assuming fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz is an FCIDUMP file.
-2024-12-14 14:03:35,218 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz...
-2024-12-14 14:03:35,223 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:03:35,872 - INFO - Authentication (publickey) successful!
-2024-12-14 14:03:35,887 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:03:45,755 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:04:01,874 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:04:01,874 - INFO - supporting data file UUID: 94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.
-2024-12-14 14:04:01,874 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vtz.94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.chk.
-2024-12-14 14:04:01,874 - INFO - assuming Cr1_vtz.94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:04:01,879 - INFO - parsing ../problem_instances/problem_instance.Ti_1.9823b0dd-87b6-4793-9741-e8cbcf2b50c0.json
-2024-12-14 14:04:01,879 - INFO - problem_instance UUID: 9823b0dd-87b6-4793-9741-e8cbcf2b50c0
-2024-12-14 14:04:01,879 - INFO - problem_instance short name: Ti_1
-2024-12-14 14:04:01,879 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:04:01,894 - INFO - Analyzing task 2cd76a23-0514-458a-b588-94e2d10564d3...
-2024-12-14 14:04:01,895 - INFO - number of supporting files: 2
-2024-12-14 14:04:01,895 - INFO - supporting data file UUID: 760e312c-9982-486d-b50e-d9acb003aedc.
-2024-12-14 14:04:01,895 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz.
-2024-12-14 14:04:01,895 - INFO - assuming fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz is an FCIDUMP file.
-2024-12-14 14:04:01,895 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz...
-2024-12-14 14:04:01,901 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:04:02,620 - INFO - Authentication (publickey) successful!
-2024-12-14 14:04:02,642 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:04:03,830 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:04:07,485 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 14:04:07,485 - INFO - supporting data file UUID: c4414ea6-320e-4c98-89ef-cc16d7932fd7.
-2024-12-14 14:04:07,485 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti1_vdz.c4414ea6-320e-4c98-89ef-cc16d7932fd7.chk.
-2024-12-14 14:04:07,486 - INFO - assuming Ti1_vdz.c4414ea6-320e-4c98-89ef-cc16d7932fd7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:04:07,486 - INFO - Analyzing task c7049602-5460-4277-8148-d9c66012f8f0...
-2024-12-14 14:04:07,486 - INFO - number of supporting files: 2
-2024-12-14 14:04:07,486 - INFO - supporting data file UUID: 2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.
-2024-12-14 14:04:07,486 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz.
-2024-12-14 14:04:07,486 - INFO - assuming fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz is an FCIDUMP file.
-2024-12-14 14:04:07,486 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz...
-2024-12-14 14:04:07,491 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:04:08,165 - INFO - Authentication (publickey) successful!
-2024-12-14 14:04:08,183 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:04:28,849 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:04:52,383 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:04:52,383 - INFO - supporting data file UUID: 1391b3e4-1862-4808-8990-dab576dade6a.
-2024-12-14 14:04:52,383 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti1_vtz.1391b3e4-1862-4808-8990-dab576dade6a.chk.
-2024-12-14 14:04:52,383 - INFO - assuming Ti1_vtz.1391b3e4-1862-4808-8990-dab576dade6a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:04:52,388 - INFO - parsing ../problem_instances/problem_instance.V_0.a14a1e28-71c5-4e23-bf6e-dd9662a6df58.json
-2024-12-14 14:04:52,388 - INFO - problem_instance UUID: a14a1e28-71c5-4e23-bf6e-dd9662a6df58
-2024-12-14 14:04:52,388 - INFO - problem_instance short name: V_0
-2024-12-14 14:04:52,388 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:04:52,404 - INFO - Analyzing task 0f0c8766-4bf5-4c1e-991a-9dafe9bc8f27...
-2024-12-14 14:04:52,404 - INFO - number of supporting files: 2
-2024-12-14 14:04:52,405 - INFO - supporting data file UUID: 950e31e2-142f-480b-b0d1-174381bdb64a.
-2024-12-14 14:04:52,405 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz.
-2024-12-14 14:04:52,405 - INFO - assuming fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz is an FCIDUMP file.
-2024-12-14 14:04:52,405 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz...
-2024-12-14 14:04:52,409 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:04:53,079 - INFO - Authentication (publickey) successful!
-2024-12-14 14:04:53,093 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:04:53,917 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:04:58,318 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 14:04:58,318 - INFO - supporting data file UUID: 5b236de2-1bb4-442b-8519-0af6e44d857d.
-2024-12-14 14:04:58,318 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V0_vdz.5b236de2-1bb4-442b-8519-0af6e44d857d.chk.
-2024-12-14 14:04:58,318 - INFO - assuming V0_vdz.5b236de2-1bb4-442b-8519-0af6e44d857d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:04:58,318 - INFO - Analyzing task 338f4b6e-775c-413b-a508-9132659ebbc3...
-2024-12-14 14:04:58,318 - INFO - number of supporting files: 2
-2024-12-14 14:04:58,319 - INFO - supporting data file UUID: d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.
-2024-12-14 14:04:58,319 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz.
-2024-12-14 14:04:58,319 - INFO - assuming fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz is an FCIDUMP file.
-2024-12-14 14:04:58,319 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz...
-2024-12-14 14:04:58,324 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:04:58,957 - INFO - Authentication (publickey) successful!
-2024-12-14 14:04:58,973 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:05:35,388 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:06:07,332 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:06:07,332 - INFO - supporting data file UUID: 1c843e96-bab4-4f23-8a9e-df61638fb804.
-2024-12-14 14:06:07,332 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V0_vtz.1c843e96-bab4-4f23-8a9e-df61638fb804.chk.
-2024-12-14 14:06:07,332 - INFO - assuming V0_vtz.1c843e96-bab4-4f23-8a9e-df61638fb804.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:06:07,337 - INFO - parsing ../problem_instances/problem_instance.CuO_0.886ad5bf-d487-48c8-b08c-c9f82b84ed5d.json
-2024-12-14 14:06:07,337 - INFO - problem_instance UUID: 886ad5bf-d487-48c8-b08c-c9f82b84ed5d
-2024-12-14 14:06:07,337 - INFO - problem_instance short name: CuO_0
-2024-12-14 14:06:07,337 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:06:07,353 - INFO - Analyzing task 37e1f17b-384d-423d-860b-c75b9dcff951...
-2024-12-14 14:06:07,353 - INFO - number of supporting files: 2
-2024-12-14 14:06:07,353 - INFO - supporting data file UUID: da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.
-2024-12-14 14:06:07,353 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz.
-2024-12-14 14:06:07,353 - INFO - assuming fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz is an FCIDUMP file.
-2024-12-14 14:06:07,353 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz...
-2024-12-14 14:06:07,358 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:06:07,991 - INFO - Authentication (publickey) successful!
-2024-12-14 14:06:08,005 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:06:17,040 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:06:31,620 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 14:06:31,620 - INFO - supporting data file UUID: c4e62caf-cab0-444f-88f2-ce58f87079f2.
-2024-12-14 14:06:31,620 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/CuO_vdz.c4e62caf-cab0-444f-88f2-ce58f87079f2.chk.
-2024-12-14 14:06:31,620 - INFO - assuming CuO_vdz.c4e62caf-cab0-444f-88f2-ce58f87079f2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:06:31,622 - INFO - parsing ../problem_instances/problem_instance.TiO_0.0b91f99e-8de5-415d-a78e-f80e45d621ca.json
-2024-12-14 14:06:31,622 - INFO - problem_instance UUID: 0b91f99e-8de5-415d-a78e-f80e45d621ca
-2024-12-14 14:06:31,622 - INFO - problem_instance short name: TiO_0
-2024-12-14 14:06:31,622 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:06:31,634 - INFO - Analyzing task 84aa9e2d-18e6-4689-9274-28e89ef44080...
-2024-12-14 14:06:31,634 - INFO - number of supporting files: 2
-2024-12-14 14:06:31,634 - INFO - supporting data file UUID: 98719f34-8ba8-4557-a9fd-b28a84fe7dd1.
-2024-12-14 14:06:31,634 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz.
-2024-12-14 14:06:31,634 - INFO - assuming fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz is an FCIDUMP file.
-2024-12-14 14:06:31,634 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz...
-2024-12-14 14:06:31,640 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:06:32,290 - INFO - Authentication (publickey) successful!
-2024-12-14 14:06:32,308 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:06:39,988 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:06:54,346 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 14:06:54,346 - INFO - supporting data file UUID: bee1776c-8031-4f23-a403-4475699e873f.
-2024-12-14 14:06:54,346 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/TiO_vdz.bee1776c-8031-4f23-a403-4475699e873f.chk.
-2024-12-14 14:06:54,346 - INFO - assuming TiO_vdz.bee1776c-8031-4f23-a403-4475699e873f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:06:54,348 - INFO - parsing ../problem_instances/problem_instance.na2_0.edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76.json
-2024-12-14 14:06:54,348 - INFO - problem_instance UUID: edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76
-2024-12-14 14:06:54,348 - INFO - problem_instance short name: na2_0
-2024-12-14 14:06:54,348 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:06:54,364 - INFO - Analyzing task 4fb7e994-8e7a-4acd-86d4-bb52db824cfc...
-2024-12-14 14:06:54,364 - INFO - number of supporting files: 2
-2024-12-14 14:06:54,364 - INFO - supporting data file UUID: 4ceb8edc-937e-4cb6-9e42-51b6760b2557.
-2024-12-14 14:06:54,364 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz.
-2024-12-14 14:06:54,364 - INFO - assuming fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz is an FCIDUMP file.
-2024-12-14 14:06:54,364 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz...
-2024-12-14 14:06:54,369 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:06:55,004 - INFO - Authentication (publickey) successful!
-2024-12-14 14:06:55,020 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:06:55,147 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:06:55,841 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 14:06:55,841 - INFO - supporting data file UUID: 2014a3d7-1779-4d85-810f-ab908557987f.
-2024-12-14 14:06:55,841 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVDZ.2014a3d7-1779-4d85-810f-ab908557987f.chk.
-2024-12-14 14:06:55,841 - INFO - assuming na2_cc-pVDZ.2014a3d7-1779-4d85-810f-ab908557987f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:06:55,841 - INFO - Analyzing task f96de7fe-5c88-4083-8c48-72bc094cccfd...
-2024-12-14 14:06:55,841 - INFO - number of supporting files: 2
-2024-12-14 14:06:55,841 - INFO - supporting data file UUID: 4d93ba0f-4ad6-4107-b495-9284d226e13d.
-2024-12-14 14:06:55,841 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz.
-2024-12-14 14:06:55,841 - INFO - assuming fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz is an FCIDUMP file.
-2024-12-14 14:06:55,841 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz...
-2024-12-14 14:06:55,846 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:06:56,491 - INFO - Authentication (publickey) successful!
-2024-12-14 14:06:56,504 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:08:56,873 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:09:50,054 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 14:09:50,054 - INFO - supporting data file UUID: 299611a7-6df9-4cdd-ada5-ae74e038f77c.
-2024-12-14 14:09:50,054 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVQZ.299611a7-6df9-4cdd-ada5-ae74e038f77c.chk.
-2024-12-14 14:09:50,054 - INFO - assuming na2_cc-pVQZ.299611a7-6df9-4cdd-ada5-ae74e038f77c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:09:50,054 - INFO - Analyzing task 620e9ff4-07bf-4767-9237-d39aa659b8e5...
-2024-12-14 14:09:50,054 - INFO - number of supporting files: 2
-2024-12-14 14:09:50,054 - INFO - supporting data file UUID: c288da42-cf53-4437-a310-24bf3e35e008.
-2024-12-14 14:09:50,054 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz.
-2024-12-14 14:09:50,054 - INFO - assuming fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz is an FCIDUMP file.
-2024-12-14 14:09:50,054 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz...
-2024-12-14 14:09:50,060 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:09:50,704 - INFO - Authentication (publickey) successful!
-2024-12-14 14:09:50,725 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:09:52,503 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:09:59,488 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 14:09:59,489 - INFO - supporting data file UUID: 74e99e36-315d-4e29-a4c9-2ae0b1c932d6.
-2024-12-14 14:09:59,489 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVTZ.74e99e36-315d-4e29-a4c9-2ae0b1c932d6.chk.
-2024-12-14 14:09:59,489 - INFO - assuming na2_cc-pVTZ.74e99e36-315d-4e29-a4c9-2ae0b1c932d6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:09:59,490 - INFO - parsing ../problem_instances/problem_instance.mn_mono.cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8.json
-2024-12-14 14:09:59,491 - INFO - problem_instance UUID: cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8
-2024-12-14 14:09:59,491 - INFO - problem_instance short name: mn_mono
-2024-12-14 14:09:59,491 - INFO - contains 8 associated Hamiltonians.
-2024-12-14 14:09:59,506 - INFO - Analyzing task de3ea361-c2d3-4ab6-add4-ccd43cea6aa8...
-2024-12-14 14:09:59,506 - INFO - number of supporting files: 1
-2024-12-14 14:09:59,506 - INFO - supporting data file UUID: 68af0b80-3d27-4aba-84f9-bcdd30a9255b.
-2024-12-14 14:09:59,506 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz.
-2024-12-14 14:09:59,506 - INFO - assuming fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz is an FCIDUMP file.
-2024-12-14 14:09:59,507 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz...
-2024-12-14 14:09:59,513 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:10:00,174 - INFO - Authentication (publickey) successful!
-2024-12-14 14:10:00,189 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:10:00,248 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:10:00,267 - INFO - ===============================================
-2024-12-14 14:10:00,267 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:10:12,065 - INFO - Circuit initialization time: 11.79833 seconds.
-2024-12-14 14:10:12,065 - INFO - Estimating logical resources...
-2024-12-14 14:10:15,496 - INFO - Resource estimation time (seconds): 3.430731
-2024-12-14 14:10:15,496 - INFO - Analyzing task 6c39d3a7-c71a-4049-a8c7-3a3a4b61d8da...
-2024-12-14 14:10:15,497 - INFO - number of supporting files: 1
-2024-12-14 14:10:15,497 - INFO - supporting data file UUID: 28a7820f-63fe-4920-aeec-a7ffe7e55d83.
-2024-12-14 14:10:15,497 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz.
-2024-12-14 14:10:15,497 - INFO - assuming fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz is an FCIDUMP file.
-2024-12-14 14:10:15,497 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz...
-2024-12-14 14:10:15,503 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:10:16,166 - INFO - Authentication (publickey) successful!
-2024-12-14 14:10:16,179 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:10:16,281 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:10:16,646 - INFO - ===============================================
-2024-12-14 14:10:16,646 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:14:12,695 - INFO - Circuit initialization time: 236.049405 seconds.
-2024-12-14 14:14:12,696 - INFO - Estimating logical resources...
-2024-12-14 14:14:36,461 - INFO - Resource estimation time (seconds): 23.764988
-2024-12-14 14:14:36,461 - INFO - Analyzing task 1ade03f3-06b1-4e95-b271-fea5a6343829...
-2024-12-14 14:14:36,461 - INFO - number of supporting files: 1
-2024-12-14 14:14:36,461 - INFO - supporting data file UUID: f738fcd6-7ddc-4d70-8ff9-4019e3718b04.
-2024-12-14 14:14:36,461 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz.
-2024-12-14 14:14:36,461 - INFO - assuming fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz is an FCIDUMP file.
-2024-12-14 14:14:36,461 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz...
-2024-12-14 14:14:36,465 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:14:37,130 - INFO - Authentication (publickey) successful!
-2024-12-14 14:14:37,144 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:14:37,198 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:14:37,217 - INFO - ===============================================
-2024-12-14 14:14:37,217 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:14:49,014 - INFO - Circuit initialization time: 11.796772 seconds.
-2024-12-14 14:14:49,014 - INFO - Estimating logical resources...
-2024-12-14 14:14:52,549 - INFO - Resource estimation time (seconds): 3.53481
-2024-12-14 14:14:52,549 - INFO - Analyzing task ff0da1e2-2c76-4589-aefa-c13bb1a1ef8f...
-2024-12-14 14:14:52,550 - INFO - number of supporting files: 1
-2024-12-14 14:14:52,550 - INFO - supporting data file UUID: 6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.
-2024-12-14 14:14:52,550 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz.
-2024-12-14 14:14:52,550 - INFO - assuming fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz is an FCIDUMP file.
-2024-12-14 14:14:52,550 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz...
-2024-12-14 14:14:52,555 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:14:53,259 - INFO - Authentication (publickey) successful!
-2024-12-14 14:14:53,273 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:14:53,355 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:14:53,758 - INFO - ===============================================
-2024-12-14 14:14:53,758 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:19:24,730 - INFO - Circuit initialization time: 270.972011 seconds.
-2024-12-14 14:19:24,730 - INFO - Estimating logical resources...
-2024-12-14 14:19:58,174 - INFO - Resource estimation time (seconds): 33.444072
-2024-12-14 14:19:58,174 - INFO - Analyzing task a9c90f98-6557-44d2-9ca0-0c9122f4080c...
-2024-12-14 14:19:58,174 - INFO - number of supporting files: 1
-2024-12-14 14:19:58,174 - INFO - supporting data file UUID: 027490ba-34f9-4340-89ab-27fd110d2821.
-2024-12-14 14:19:58,174 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz.
-2024-12-14 14:19:58,175 - INFO - assuming fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz is an FCIDUMP file.
-2024-12-14 14:19:58,175 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz...
-2024-12-14 14:19:58,181 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:19:58,661 - INFO - Authentication (publickey) successful!
-2024-12-14 14:19:58,680 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:19:58,742 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:19:58,770 - INFO - ===============================================
-2024-12-14 14:19:58,770 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:20:08,448 - INFO - Circuit initialization time: 9.677917 seconds.
-2024-12-14 14:20:08,448 - INFO - Estimating logical resources...
-2024-12-14 14:20:11,931 - INFO - Resource estimation time (seconds): 3.482612
-2024-12-14 14:20:11,931 - INFO - Analyzing task a16168e2-98cd-430d-a180-84f64b4d5e75...
-2024-12-14 14:20:11,931 - INFO - number of supporting files: 1
-2024-12-14 14:20:11,931 - INFO - supporting data file UUID: bae2da57-6a69-483e-95bc-b77f72ebfba8.
-2024-12-14 14:20:11,931 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz.
-2024-12-14 14:20:11,931 - INFO - assuming fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz is an FCIDUMP file.
-2024-12-14 14:20:11,931 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz...
-2024-12-14 14:20:11,936 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:20:12,591 - INFO - Authentication (publickey) successful!
-2024-12-14 14:20:12,604 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:20:12,687 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:20:13,096 - INFO - ===============================================
-2024-12-14 14:20:13,097 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:24:44,300 - INFO - Circuit initialization time: 271.203765 seconds.
-2024-12-14 14:24:44,301 - INFO - Estimating logical resources...
-2024-12-14 14:25:22,989 - INFO - Resource estimation time (seconds): 38.688265
-2024-12-14 14:25:22,989 - INFO - Analyzing task 590c2f0b-964b-4d09-96ad-101a9be59cab...
-2024-12-14 14:25:22,989 - INFO - number of supporting files: 1
-2024-12-14 14:25:22,989 - INFO - supporting data file UUID: 72343006-774e-4192-b481-fa840ed25573.
-2024-12-14 14:25:22,989 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz.
-2024-12-14 14:25:22,989 - INFO - assuming fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz is an FCIDUMP file.
-2024-12-14 14:25:22,990 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz...
-2024-12-14 14:25:22,995 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:25:23,661 - INFO - Authentication (publickey) successful!
-2024-12-14 14:25:23,680 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:25:23,732 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:25:23,752 - INFO - ===============================================
-2024-12-14 14:25:23,752 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:25:34,909 - INFO - Circuit initialization time: 11.156407 seconds.
-2024-12-14 14:25:34,909 - INFO - Estimating logical resources...
-2024-12-14 14:25:38,217 - INFO - Resource estimation time (seconds): 3.308036
-2024-12-14 14:25:38,217 - INFO - Analyzing task 6e617348-d0b3-4b6d-9923-ea54ba5cf751...
-2024-12-14 14:25:38,217 - INFO - number of supporting files: 1
-2024-12-14 14:25:38,217 - INFO - supporting data file UUID: ea55abec-8253-445d-85fa-914948b5e5a5.
-2024-12-14 14:25:38,217 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz.
-2024-12-14 14:25:38,217 - INFO - assuming fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz is an FCIDUMP file.
-2024-12-14 14:25:38,217 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz...
-2024-12-14 14:25:38,224 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:25:38,879 - INFO - Authentication (publickey) successful!
-2024-12-14 14:25:38,895 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:25:38,990 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:25:39,403 - INFO - ===============================================
-2024-12-14 14:25:39,403 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:30:14,435 - INFO - Circuit initialization time: 275.031716 seconds.
-2024-12-14 14:30:14,435 - INFO - Estimating logical resources...
-2024-12-14 14:30:53,422 - INFO - Resource estimation time (seconds): 38.986343
-2024-12-14 14:30:53,425 - INFO - parsing ../problem_instances/problem_instance.FeO_0.55d0ed82-0560-4448-8459-c2ba00654d9d.json
-2024-12-14 14:30:53,425 - INFO - problem_instance UUID: 55d0ed82-0560-4448-8459-c2ba00654d9d
-2024-12-14 14:30:53,425 - INFO - problem_instance short name: FeO_0
-2024-12-14 14:30:53,425 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:30:53,442 - INFO - Analyzing task b8344eb5-f574-4198-b917-8312240ba288...
-2024-12-14 14:30:53,442 - INFO - number of supporting files: 2
-2024-12-14 14:30:53,442 - INFO - supporting data file UUID: 3f1777dc-c493-4aa7-b3d1-6271d9bed459.
-2024-12-14 14:30:53,442 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz.
-2024-12-14 14:30:53,442 - INFO - assuming fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz is an FCIDUMP file.
-2024-12-14 14:30:53,442 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz...
-2024-12-14 14:30:53,447 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:30:54,092 - INFO - Authentication (publickey) successful!
-2024-12-14 14:30:54,107 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:31:00,775 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:31:14,070 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 14:31:14,070 - INFO - supporting data file UUID: 8bb3298d-0a60-4249-bfc5-94f399fbd522.
-2024-12-14 14:31:14,070 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/FeO_vdz.8bb3298d-0a60-4249-bfc5-94f399fbd522.chk.
-2024-12-14 14:31:14,070 - INFO - assuming FeO_vdz.8bb3298d-0a60-4249-bfc5-94f399fbd522.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:31:14,074 - INFO - parsing ../problem_instances/problem_instance.p_h3_0.0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57.json
-2024-12-14 14:31:14,074 - INFO - problem_instance UUID: 0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57
-2024-12-14 14:31:14,074 - INFO - problem_instance short name: p_h3_0
-2024-12-14 14:31:14,074 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:31:14,089 - INFO - Analyzing task af399f2b-a4f8-4fec-aca2-7c126ed989a5...
-2024-12-14 14:31:14,090 - INFO - number of supporting files: 2
-2024-12-14 14:31:14,090 - INFO - supporting data file UUID: 7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.
-2024-12-14 14:31:14,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz.
-2024-12-14 14:31:14,090 - INFO - assuming fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz is an FCIDUMP file.
-2024-12-14 14:31:14,090 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz...
-2024-12-14 14:31:14,095 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:31:14,753 - INFO - Authentication (publickey) successful!
-2024-12-14 14:31:14,767 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:31:14,932 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:31:15,949 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 14:31:15,950 - INFO - supporting data file UUID: e7dafb07-2975-4414-9924-2f8037778aee.
-2024-12-14 14:31:15,950 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p_h3_cc-pVDZ.e7dafb07-2975-4414-9924-2f8037778aee.chk.
-2024-12-14 14:31:15,950 - INFO - assuming p_h3_cc-pVDZ.e7dafb07-2975-4414-9924-2f8037778aee.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:31:15,950 - INFO - Analyzing task 819ff18a-5aad-46df-83ef-bd209e44936b...
-2024-12-14 14:31:15,950 - INFO - number of supporting files: 2
-2024-12-14 14:31:15,950 - INFO - supporting data file UUID: 2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.
-2024-12-14 14:31:15,950 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz.
-2024-12-14 14:31:15,950 - INFO - assuming fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz is an FCIDUMP file.
-2024-12-14 14:31:15,950 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz...
-2024-12-14 14:31:15,957 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:31:16,609 - INFO - Authentication (publickey) successful!
-2024-12-14 14:31:16,624 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:31:44,579 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:32:11,420 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 14:32:11,420 - INFO - supporting data file UUID: b8c794eb-a077-4227-9777-80462e7beefd.
-2024-12-14 14:32:11,420 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p_h3_cc-pVTZ.b8c794eb-a077-4227-9777-80462e7beefd.chk.
-2024-12-14 14:32:11,420 - INFO - assuming p_h3_cc-pVTZ.b8c794eb-a077-4227-9777-80462e7beefd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:32:11,424 - INFO - parsing ../problem_instances/problem_instance.h2_s_0.208f2e50-2b56-4e72-815a-cba5cec1264c.json
-2024-12-14 14:32:11,424 - INFO - problem_instance UUID: 208f2e50-2b56-4e72-815a-cba5cec1264c
-2024-12-14 14:32:11,424 - INFO - problem_instance short name: h2_s_0
-2024-12-14 14:32:11,424 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:32:11,440 - INFO - Analyzing task f2f09d9f-8328-4d4a-ba91-089f9e56bf0d...
-2024-12-14 14:32:11,440 - INFO - number of supporting files: 2
-2024-12-14 14:32:11,440 - INFO - supporting data file UUID: 11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.
-2024-12-14 14:32:11,440 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz.
-2024-12-14 14:32:11,440 - INFO - assuming fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz is an FCIDUMP file.
-2024-12-14 14:32:11,440 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz...
-2024-12-14 14:32:11,447 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:32:12,103 - INFO - Authentication (publickey) successful!
-2024-12-14 14:32:12,120 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:32:12,210 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:32:12,462 - INFO - ===============================================
-2024-12-14 14:32:12,462 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:33:30,843 - INFO - Circuit initialization time: 78.380456 seconds.
-2024-12-14 14:33:30,843 - INFO - Estimating logical resources...
-2024-12-14 14:33:48,135 - INFO - Resource estimation time (seconds): 17.291935
-2024-12-14 14:33:48,135 - INFO - supporting data file UUID: b28fc567-776a-49e9-b537-f885125f2e41.
-2024-12-14 14:33:48,136 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVDZ.b28fc567-776a-49e9-b537-f885125f2e41.chk.
-2024-12-14 14:33:48,136 - INFO - assuming h2_s_cc-pVDZ.b28fc567-776a-49e9-b537-f885125f2e41.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:33:48,136 - INFO - Analyzing task 3d5186f9-82b3-4de0-9bc1-242d7bdb678a...
-2024-12-14 14:33:48,136 - INFO - number of supporting files: 2
-2024-12-14 14:33:48,136 - INFO - supporting data file UUID: 57afbbf8-5819-4ee7-b540-95974b8a1a3f.
-2024-12-14 14:33:48,136 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz.
-2024-12-14 14:33:48,136 - INFO - assuming fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz is an FCIDUMP file.
-2024-12-14 14:33:48,136 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz...
-2024-12-14 14:33:48,141 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:33:48,805 - INFO - Authentication (publickey) successful!
-2024-12-14 14:33:48,834 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:36:17,156 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:37:18,793 - INFO - Skipping Logical Resource Estimate because number of orbitals (119) exceeds maximum specified in config (32).
-2024-12-14 14:37:18,794 - INFO - supporting data file UUID: 6474909a-c9c8-4e8b-be9c-71207ece21ea.
-2024-12-14 14:37:18,794 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVQZ.6474909a-c9c8-4e8b-be9c-71207ece21ea.chk.
-2024-12-14 14:37:18,794 - INFO - assuming h2_s_cc-pVQZ.6474909a-c9c8-4e8b-be9c-71207ece21ea.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:37:18,794 - INFO - Analyzing task ec0baf59-05f5-49df-b5e5-8f887d822a10...
-2024-12-14 14:37:18,794 - INFO - number of supporting files: 2
-2024-12-14 14:37:18,794 - INFO - supporting data file UUID: 83f0f242-e184-4581-a77a-f019731d8a6f.
-2024-12-14 14:37:18,794 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz.
-2024-12-14 14:37:18,794 - INFO - assuming fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz is an FCIDUMP file.
-2024-12-14 14:37:18,794 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz...
-2024-12-14 14:37:18,799 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:37:19,335 - INFO - Authentication (publickey) successful!
-2024-12-14 14:37:19,350 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:37:20,566 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:37:25,238 - INFO - Skipping Logical Resource Estimate because number of orbitals (62) exceeds maximum specified in config (32).
-2024-12-14 14:37:25,238 - INFO - supporting data file UUID: 2081f24a-d7ea-452a-b9bc-9901d06282d6.
-2024-12-14 14:37:25,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVTZ.2081f24a-d7ea-452a-b9bc-9901d06282d6.chk.
-2024-12-14 14:37:25,239 - INFO - assuming h2_s_cc-pVTZ.2081f24a-d7ea-452a-b9bc-9901d06282d6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:37:25,244 - INFO - parsing ../problem_instances/problem_instance.Sc_0.67f72316-2262-44fb-8c0a-e159e1cd0cf0.json
-2024-12-14 14:37:25,245 - INFO - problem_instance UUID: 67f72316-2262-44fb-8c0a-e159e1cd0cf0
-2024-12-14 14:37:25,245 - INFO - problem_instance short name: Sc_0
-2024-12-14 14:37:25,245 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:37:25,262 - INFO - Analyzing task fb87d637-aaab-4e8f-8898-4ecca8bd0fe0...
-2024-12-14 14:37:25,262 - INFO - number of supporting files: 2
-2024-12-14 14:37:25,262 - INFO - supporting data file UUID: 9da0b1fb-c6a5-4da5-b390-3920e3c26154.
-2024-12-14 14:37:25,262 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz.
-2024-12-14 14:37:25,262 - INFO - assuming fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz is an FCIDUMP file.
-2024-12-14 14:37:25,262 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz...
-2024-12-14 14:37:25,267 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:37:25,932 - INFO - Authentication (publickey) successful!
-2024-12-14 14:37:25,952 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:37:26,413 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:37:29,388 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 14:37:29,388 - INFO - supporting data file UUID: 11066a5f-4cab-41ed-9bcf-bc34a77d52c6.
-2024-12-14 14:37:29,388 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vdz.11066a5f-4cab-41ed-9bcf-bc34a77d52c6.chk.
-2024-12-14 14:37:29,388 - INFO - assuming Sc0_vdz.11066a5f-4cab-41ed-9bcf-bc34a77d52c6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:37:29,389 - INFO - Analyzing task 96c6a0d7-8a1e-4189-a934-833b80ade346...
-2024-12-14 14:37:29,389 - INFO - number of supporting files: 2
-2024-12-14 14:37:29,389 - INFO - supporting data file UUID: 85c6b46a-59fe-4506-89d3-e6faec2383e2.
-2024-12-14 14:37:29,389 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz.
-2024-12-14 14:37:29,389 - INFO - assuming fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz is an FCIDUMP file.
-2024-12-14 14:37:29,389 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz...
-2024-12-14 14:37:29,393 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:37:30,043 - INFO - Authentication (publickey) successful!
-2024-12-14 14:37:30,059 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:41:03,703 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:42:18,747 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-14 14:42:18,747 - INFO - supporting data file UUID: 814f1b4d-2820-4c3f-8367-05f604deee43.
-2024-12-14 14:42:18,747 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vqz.814f1b4d-2820-4c3f-8367-05f604deee43.chk.
-2024-12-14 14:42:18,748 - INFO - assuming Sc0_vqz.814f1b4d-2820-4c3f-8367-05f604deee43.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:42:18,748 - INFO - Analyzing task dc1da839-0ccc-434c-bf9c-a3874ffc3b1c...
-2024-12-14 14:42:18,748 - INFO - number of supporting files: 2
-2024-12-14 14:42:18,748 - INFO - supporting data file UUID: 83008296-5ec9-4af7-a03b-372025fad080.
-2024-12-14 14:42:18,748 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz.
-2024-12-14 14:42:18,748 - INFO - assuming fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz is an FCIDUMP file.
-2024-12-14 14:42:18,748 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz...
-2024-12-14 14:42:18,753 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:42:19,396 - INFO - Authentication (publickey) successful!
-2024-12-14 14:42:19,410 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:42:25,914 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:42:38,965 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:42:38,965 - INFO - supporting data file UUID: 0a3909ae-25ab-4fd7-8625-12a477404329.
-2024-12-14 14:42:38,965 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vtz.0a3909ae-25ab-4fd7-8625-12a477404329.chk.
-2024-12-14 14:42:38,965 - INFO - assuming Sc0_vtz.0a3909ae-25ab-4fd7-8625-12a477404329.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:42:38,971 - INFO - parsing ../problem_instances/problem_instance.na_cl_0.3f141f05-532b-478d-b38a-2ae07baadc88.json
-2024-12-14 14:42:38,971 - INFO - problem_instance UUID: 3f141f05-532b-478d-b38a-2ae07baadc88
-2024-12-14 14:42:38,971 - INFO - problem_instance short name: na_cl_0
-2024-12-14 14:42:38,971 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:42:38,987 - INFO - Analyzing task da831b60-89ce-4c01-96f9-c9f8a4512aab...
-2024-12-14 14:42:38,987 - INFO - number of supporting files: 2
-2024-12-14 14:42:38,987 - INFO - supporting data file UUID: cd31956d-bef5-4112-9959-510170644e72.
-2024-12-14 14:42:38,987 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz.
-2024-12-14 14:42:38,987 - INFO - assuming fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz is an FCIDUMP file.
-2024-12-14 14:42:38,987 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz...
-2024-12-14 14:42:38,997 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:42:39,654 - INFO - Authentication (publickey) successful!
-2024-12-14 14:42:39,676 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:42:39,782 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:42:40,455 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 14:42:40,455 - INFO - supporting data file UUID: 54f78447-2f62-48c7-a584-037808c4e08c.
-2024-12-14 14:42:40,456 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVDZ.54f78447-2f62-48c7-a584-037808c4e08c.chk.
-2024-12-14 14:42:40,456 - INFO - assuming na_cl_cc-pVDZ.54f78447-2f62-48c7-a584-037808c4e08c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:42:40,456 - INFO - Analyzing task a2f9649f-0f47-4a5d-a6a7-b0bebc848797...
-2024-12-14 14:42:40,456 - INFO - number of supporting files: 2
-2024-12-14 14:42:40,456 - INFO - supporting data file UUID: 677d97ee-5a46-4d49-82d6-ca3fc98a59a7.
-2024-12-14 14:42:40,456 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz.
-2024-12-14 14:42:40,456 - INFO - assuming fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz is an FCIDUMP file.
-2024-12-14 14:42:40,456 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz...
-2024-12-14 14:42:40,471 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:42:40,966 - INFO - Authentication (publickey) successful!
-2024-12-14 14:42:40,982 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:45:12,201 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:18,873 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 14:46:18,874 - INFO - supporting data file UUID: fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.
-2024-12-14 14:46:18,874 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVQZ.fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.chk.
-2024-12-14 14:46:18,874 - INFO - assuming na_cl_cc-pVQZ.fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:46:18,874 - INFO - Analyzing task 01ec60f7-d38a-4c33-a498-659a388e10ee...
-2024-12-14 14:46:18,874 - INFO - number of supporting files: 2
-2024-12-14 14:46:18,874 - INFO - supporting data file UUID: 444f3f27-904b-463f-b2f2-c92686c9637d.
-2024-12-14 14:46:18,874 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz.
-2024-12-14 14:46:18,874 - INFO - assuming fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz is an FCIDUMP file.
-2024-12-14 14:46:18,874 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz...
-2024-12-14 14:46:18,881 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:46:19,542 - INFO - Authentication (publickey) successful!
-2024-12-14 14:46:19,555 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:46:21,936 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:30,409 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 14:46:30,409 - INFO - supporting data file UUID: 0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.
-2024-12-14 14:46:30,409 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVTZ.0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.chk.
-2024-12-14 14:46:30,410 - INFO - assuming na_cl_cc-pVTZ.0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:46:30,412 - INFO - parsing ../problem_instances/problem_instance.c2_h2_0.0ca102a7-dad4-4d42-8c73-9acfa45378d7.json
-2024-12-14 14:46:30,413 - INFO - problem_instance UUID: 0ca102a7-dad4-4d42-8c73-9acfa45378d7
-2024-12-14 14:46:30,413 - INFO - problem_instance short name: c2_h2_0
-2024-12-14 14:46:30,413 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:46:30,428 - INFO - Analyzing task 2761e36e-f001-42af-8086-f507b5643ec8...
-2024-12-14 14:46:30,428 - INFO - number of supporting files: 2
-2024-12-14 14:46:30,428 - INFO - supporting data file UUID: 5b507b3d-b6fc-4e13-9586-06113819d99f.
-2024-12-14 14:46:30,428 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz.
-2024-12-14 14:46:30,428 - INFO - assuming fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz is an FCIDUMP file.
-2024-12-14 14:46:30,428 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz...
-2024-12-14 14:46:30,433 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:46:31,063 - INFO - Authentication (publickey) successful!
-2024-12-14 14:46:31,080 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:46:31,192 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:31,806 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 14:46:31,806 - INFO - supporting data file UUID: 7d37092e-ec2a-4cc0-b18a-211e358f2a3d.
-2024-12-14 14:46:31,806 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h2_cc-pVDZ.7d37092e-ec2a-4cc0-b18a-211e358f2a3d.chk.
-2024-12-14 14:46:31,806 - INFO - assuming c2_h2_cc-pVDZ.7d37092e-ec2a-4cc0-b18a-211e358f2a3d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:46:31,806 - INFO - Analyzing task b1352b0c-aa96-4f58-a0e2-356d3c43c8a1...
-2024-12-14 14:46:31,806 - INFO - number of supporting files: 2
-2024-12-14 14:46:31,806 - INFO - supporting data file UUID: 57793481-c847-4746-8241-ea949add5f87.
-2024-12-14 14:46:31,806 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz.
-2024-12-14 14:46:31,806 - INFO - assuming fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz is an FCIDUMP file.
-2024-12-14 14:46:31,806 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz...
-2024-12-14 14:46:31,812 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:46:32,877 - INFO - Authentication (publickey) successful!
-2024-12-14 14:46:32,901 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:46:42,176 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:57,552 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:46:57,552 - INFO - supporting data file UUID: f6d434e3-5c53-44f3-80ac-da5e7851f45a.
-2024-12-14 14:46:57,552 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h2_cc-pVTZ.f6d434e3-5c53-44f3-80ac-da5e7851f45a.chk.
-2024-12-14 14:46:57,552 - INFO - assuming c2_h2_cc-pVTZ.f6d434e3-5c53-44f3-80ac-da5e7851f45a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:46:57,558 - INFO - parsing ../problem_instances/problem_instance.li_f_0.e48e7467-1fcd-478b-a599-f4ce881c57b9.json
-2024-12-14 14:46:57,558 - INFO - problem_instance UUID: e48e7467-1fcd-478b-a599-f4ce881c57b9
-2024-12-14 14:46:57,558 - INFO - problem_instance short name: li_f_0
-2024-12-14 14:46:57,558 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:46:57,575 - INFO - Analyzing task 80043b93-039c-4d5a-abcb-84b8f25f7abb...
-2024-12-14 14:46:57,575 - INFO - number of supporting files: 2
-2024-12-14 14:46:57,575 - INFO - supporting data file UUID: 19cf5a4d-e90f-4ab1-a062-b20089724a63.
-2024-12-14 14:46:57,575 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz.
-2024-12-14 14:46:57,575 - INFO - assuming fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz is an FCIDUMP file.
-2024-12-14 14:46:57,575 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz...
-2024-12-14 14:46:57,581 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:46:58,239 - INFO - Authentication (publickey) successful!
-2024-12-14 14:46:58,253 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:46:58,333 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:58,603 - INFO - ===============================================
-2024-12-14 14:46:58,603 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:48:43,432 - INFO - Circuit initialization time: 104.829323 seconds.
-2024-12-14 14:48:43,432 - INFO - Estimating logical resources...
-2024-12-14 14:48:59,893 - INFO - Resource estimation time (seconds): 16.460609
-2024-12-14 14:48:59,893 - INFO - supporting data file UUID: e04452b6-2617-4dd7-a493-1d3e5e02639a.
-2024-12-14 14:48:59,893 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVDZ.e04452b6-2617-4dd7-a493-1d3e5e02639a.chk.
-2024-12-14 14:48:59,893 - INFO - assuming li_f_cc-pVDZ.e04452b6-2617-4dd7-a493-1d3e5e02639a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:48:59,894 - INFO - Analyzing task 0485949f-722c-49ee-a748-eec54801f021...
-2024-12-14 14:48:59,894 - INFO - number of supporting files: 2
-2024-12-14 14:48:59,894 - INFO - supporting data file UUID: 2294b211-7a05-445e-810d-4c1706e1444c.
-2024-12-14 14:48:59,894 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz.
-2024-12-14 14:48:59,894 - INFO - assuming fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz is an FCIDUMP file.
-2024-12-14 14:48:59,894 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz...
-2024-12-14 14:48:59,899 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:49:00,532 - INFO - Authentication (publickey) successful!
-2024-12-14 14:49:00,547 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:50:29,176 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:17,238 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 14:51:17,239 - INFO - supporting data file UUID: e2d31834-f73d-46a0-ba41-fa67b298611c.
-2024-12-14 14:51:17,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVQZ.e2d31834-f73d-46a0-ba41-fa67b298611c.chk.
-2024-12-14 14:51:17,239 - INFO - assuming li_f_cc-pVQZ.e2d31834-f73d-46a0-ba41-fa67b298611c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:51:17,239 - INFO - Analyzing task b80345ff-5df9-4fb3-86ab-0a25188b296d...
-2024-12-14 14:51:17,239 - INFO - number of supporting files: 2
-2024-12-14 14:51:17,239 - INFO - supporting data file UUID: c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.
-2024-12-14 14:51:17,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz.
-2024-12-14 14:51:17,240 - INFO - assuming fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz is an FCIDUMP file.
-2024-12-14 14:51:17,240 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz...
-2024-12-14 14:51:17,245 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:51:17,929 - INFO - Authentication (publickey) successful!
-2024-12-14 14:51:17,948 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:51:19,273 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:24,143 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 14:51:24,144 - INFO - supporting data file UUID: b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.
-2024-12-14 14:51:24,144 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVTZ.b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.chk.
-2024-12-14 14:51:24,144 - INFO - assuming li_f_cc-pVTZ.b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:51:24,146 - INFO - parsing ../problem_instances/problem_instance.h2_c_o_0.25fd617b-8e7f-4422-9e97-cc3f6b0d3876.json
-2024-12-14 14:51:24,146 - INFO - problem_instance UUID: 25fd617b-8e7f-4422-9e97-cc3f6b0d3876
-2024-12-14 14:51:24,146 - INFO - problem_instance short name: h2_c_o_0
-2024-12-14 14:51:24,146 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:51:24,165 - INFO - Analyzing task d58cb72b-e144-4164-aec0-309aaef6394c...
-2024-12-14 14:51:24,165 - INFO - number of supporting files: 2
-2024-12-14 14:51:24,165 - INFO - supporting data file UUID: d3d8851e-f3df-490c-975a-467933bd9fa1.
-2024-12-14 14:51:24,165 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz.
-2024-12-14 14:51:24,165 - INFO - assuming fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz is an FCIDUMP file.
-2024-12-14 14:51:24,165 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz...
-2024-12-14 14:51:24,170 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:51:24,815 - INFO - Authentication (publickey) successful!
-2024-12-14 14:51:24,830 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:51:24,943 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:25,473 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 14:51:25,473 - INFO - supporting data file UUID: 25a78420-0b29-4de5-acdc-104aa0f0b9fb.
-2024-12-14 14:51:25,473 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_c_o_cc-pVDZ.25a78420-0b29-4de5-acdc-104aa0f0b9fb.chk.
-2024-12-14 14:51:25,473 - INFO - assuming h2_c_o_cc-pVDZ.25a78420-0b29-4de5-acdc-104aa0f0b9fb.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:51:25,473 - INFO - Analyzing task ed09e1bf-40f3-4bf0-b9c7-7bb1990c5cae...
-2024-12-14 14:51:25,473 - INFO - number of supporting files: 2
-2024-12-14 14:51:25,473 - INFO - supporting data file UUID: f1c78add-0e23-423a-bb96-f1370626aa47.
-2024-12-14 14:51:25,473 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz.
-2024-12-14 14:51:25,474 - INFO - assuming fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz is an FCIDUMP file.
-2024-12-14 14:51:25,474 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz...
-2024-12-14 14:51:25,479 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:51:26,131 - INFO - Authentication (publickey) successful!
-2024-12-14 14:51:26,144 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:51:33,254 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:47,050 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:51:47,051 - INFO - supporting data file UUID: 30bd24e2-947b-4917-89bb-8bdb17406ff5.
-2024-12-14 14:51:47,051 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_c_o_cc-pVTZ.30bd24e2-947b-4917-89bb-8bdb17406ff5.chk.
-2024-12-14 14:51:47,051 - INFO - assuming h2_c_o_cc-pVTZ.30bd24e2-947b-4917-89bb-8bdb17406ff5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:51:47,059 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0011.766ba2da-e72a-4e03-a739-f97269026fc4.json
-2024-12-14 14:51:47,059 - INFO - problem_instance UUID: 766ba2da-e72a-4e03-a739-f97269026fc4
-2024-12-14 14:51:47,059 - INFO - problem_instance short name: planted_solution_0011
-2024-12-14 14:51:47,059 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:51:47,075 - INFO - Analyzing task 0021e256-8e13-42db-839d-e9155e8af82c...
-2024-12-14 14:51:47,075 - INFO - number of supporting files: 1
-2024-12-14 14:51:47,075 - INFO - supporting data file UUID: befcf6f0-cfcb-49b7-b661-de48ad8a44c8.
-2024-12-14 14:51:47,075 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz.
-2024-12-14 14:51:47,075 - INFO - assuming fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz is an FCIDUMP file.
-2024-12-14 14:51:47,075 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz...
-2024-12-14 14:51:47,081 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:51:47,737 - INFO - Authentication (publickey) successful!
-2024-12-14 14:51:47,754 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:51:47,855 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:48,216 - INFO - ===============================================
-2024-12-14 14:51:48,216 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:55:04,982 - INFO - Circuit initialization time: 196.765987 seconds.
-2024-12-14 14:55:04,982 - INFO - Estimating logical resources...
-2024-12-14 14:55:11,339 - INFO - Resource estimation time (seconds): 6.356602
-2024-12-14 14:55:11,341 - INFO - parsing ../problem_instances/problem_instance.Mn_0.bc202949-d76c-4962-b937-5c12b298b8b4.json
-2024-12-14 14:55:11,341 - INFO - problem_instance UUID: bc202949-d76c-4962-b937-5c12b298b8b4
-2024-12-14 14:55:11,341 - INFO - problem_instance short name: Mn_0
-2024-12-14 14:55:11,341 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:55:11,357 - INFO - Analyzing task 289f5dfe-e6d5-48a3-a6ae-25088321d3c6...
-2024-12-14 14:55:11,357 - INFO - number of supporting files: 2
-2024-12-14 14:55:11,357 - INFO - supporting data file UUID: a83413fb-96e3-466e-910b-6d4bab7cdf1d.
-2024-12-14 14:55:11,357 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz.
-2024-12-14 14:55:11,357 - INFO - assuming fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz is an FCIDUMP file.
-2024-12-14 14:55:11,357 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz...
-2024-12-14 14:55:11,362 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:55:12,035 - INFO - Authentication (publickey) successful!
-2024-12-14 14:55:12,055 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:55:13,266 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:55:18,445 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 14:55:18,445 - INFO - supporting data file UUID: da9344cd-a191-40aa-a0bd-726e7200facf.
-2024-12-14 14:55:18,445 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn0_vdz.da9344cd-a191-40aa-a0bd-726e7200facf.chk.
-2024-12-14 14:55:18,446 - INFO - assuming Mn0_vdz.da9344cd-a191-40aa-a0bd-726e7200facf.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:55:18,446 - INFO - Analyzing task 24f12fad-130e-44fc-8b07-bc26c5a3d878...
-2024-12-14 14:55:18,446 - INFO - number of supporting files: 2
-2024-12-14 14:55:18,446 - INFO - supporting data file UUID: 07c9da30-e172-4183-a8af-301628b75f1c.
-2024-12-14 14:55:18,446 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz.
-2024-12-14 14:55:18,446 - INFO - assuming fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz is an FCIDUMP file.
-2024-12-14 14:55:18,446 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz...
-2024-12-14 14:55:18,450 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:55:19,100 - INFO - Authentication (publickey) successful!
-2024-12-14 14:55:19,117 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:56:52,433 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:57:41,426 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:57:41,426 - INFO - supporting data file UUID: 2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.
-2024-12-14 14:57:41,426 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn0_vtz.2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.chk.
-2024-12-14 14:57:41,426 - INFO - assuming Mn0_vtz.2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:57:41,435 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0008.b57eb979-5c09-4974-97b4-5862e109a1ae.json
-2024-12-14 14:57:41,436 - INFO - problem_instance UUID: b57eb979-5c09-4974-97b4-5862e109a1ae
-2024-12-14 14:57:41,436 - INFO - problem_instance short name: planted_solution_0008
-2024-12-14 14:57:41,436 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:57:41,456 - INFO - Analyzing task af56de36-35aa-44b9-8eb7-b9c1e8f7d0f3...
-2024-12-14 14:57:41,456 - INFO - number of supporting files: 1
-2024-12-14 14:57:41,456 - INFO - supporting data file UUID: 44060124-8f2d-4a91-80a9-5a29f0f4f716.
-2024-12-14 14:57:41,456 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz.
-2024-12-14 14:57:41,456 - INFO - assuming fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz is an FCIDUMP file.
-2024-12-14 14:57:41,456 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz...
-2024-12-14 14:57:41,461 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:57:42,103 - INFO - Authentication (publickey) successful!
-2024-12-14 14:57:42,120 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:57:42,187 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:57:42,204 - INFO - ===============================================
-2024-12-14 14:57:42,204 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 14:57:51,758 - INFO - Circuit initialization time: 9.554496 seconds.
-2024-12-14 14:57:51,758 - INFO - Estimating logical resources...
-2024-12-14 14:57:53,288 - INFO - Resource estimation time (seconds): 1.529733
-2024-12-14 14:57:53,290 - INFO - parsing ../problem_instances/problem_instance.mo_n2.664ec8e4-09d5-41cc-6266-ddb26219366f.json
-2024-12-14 14:57:53,291 - INFO - problem_instance UUID: 664ec8e4-09d5-41cc-6266-ddb26219366f
-2024-12-14 14:57:53,291 - INFO - problem_instance short name: mo_n2
-2024-12-14 14:57:53,291 - INFO - contains 4 associated Hamiltonians.
-2024-12-14 14:57:53,306 - INFO - Analyzing task 00ba4917-d66a-4335-819f-43390dfc9929...
-2024-12-14 14:57:53,306 - INFO - number of supporting files: 1
-2024-12-14 14:57:53,306 - INFO - supporting data file UUID: 23aa47ca-9afe-4086-bd97-75de310e033e.
-2024-12-14 14:57:53,306 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz.
-2024-12-14 14:57:53,306 - INFO - assuming fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz is an FCIDUMP file.
-2024-12-14 14:57:53,306 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz...
-2024-12-14 14:57:53,318 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:57:53,976 - INFO - Authentication (publickey) successful!
-2024-12-14 14:57:53,988 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:57:54,078 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:57:54,488 - INFO - ===============================================
-2024-12-14 14:57:54,489 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:02:19,251 - INFO - Circuit initialization time: 264.762091 seconds.
-2024-12-14 15:02:19,251 - INFO - Estimating logical resources...
-2024-12-14 15:02:57,297 - INFO - Resource estimation time (seconds): 38.045668
-2024-12-14 15:02:57,297 - INFO - Analyzing task b9cc699a-80f8-4280-9731-23dee4d5a6a5...
-2024-12-14 15:02:57,297 - INFO - number of supporting files: 1
-2024-12-14 15:02:57,297 - INFO - supporting data file UUID: e10bd99a-435c-41cd-84f1-41bd67890fc7.
-2024-12-14 15:02:57,297 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz.
-2024-12-14 15:02:57,297 - INFO - assuming fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz is an FCIDUMP file.
-2024-12-14 15:02:57,297 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz...
-2024-12-14 15:02:57,302 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:02:57,792 - INFO - Authentication (publickey) successful!
-2024-12-14 15:02:57,806 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:02:58,095 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:03:00,126 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 15:03:00,126 - INFO - Analyzing task dfd78a05-437d-4667-88d7-7e2a3384b816...
-2024-12-14 15:03:00,126 - INFO - number of supporting files: 1
-2024-12-14 15:03:00,126 - INFO - supporting data file UUID: b71baf3c-d5f0-4f8d-aead-648ba69a058e.
-2024-12-14 15:03:00,126 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz.
-2024-12-14 15:03:00,127 - INFO - assuming fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz is an FCIDUMP file.
-2024-12-14 15:03:00,127 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz...
-2024-12-14 15:03:00,134 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:03:00,782 - INFO - Authentication (publickey) successful!
-2024-12-14 15:03:00,798 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:03:01,054 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:03:03,081 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 15:03:03,081 - INFO - Analyzing task 35c1aee4-4ef3-4e18-bc2a-377cf45e8fa1...
-2024-12-14 15:03:03,081 - INFO - number of supporting files: 1
-2024-12-14 15:03:03,081 - INFO - supporting data file UUID: 77c12db8-c32e-4f88-8552-9762a0fff763.
-2024-12-14 15:03:03,081 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz.
-2024-12-14 15:03:03,081 - INFO - assuming fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz is an FCIDUMP file.
-2024-12-14 15:03:03,081 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz...
-2024-12-14 15:03:03,086 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:03:03,717 - INFO - Authentication (publickey) successful!
-2024-12-14 15:03:03,730 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:03:03,815 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:03:04,170 - INFO - ===============================================
-2024-12-14 15:03:04,170 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:07:02,006 - INFO - Circuit initialization time: 237.835653 seconds.
-2024-12-14 15:07:02,006 - INFO - Estimating logical resources...
-2024-12-14 15:07:35,918 - INFO - Resource estimation time (seconds): 33.91144
-2024-12-14 15:07:35,920 - INFO - parsing ../problem_instances/problem_instance.li_h_0.6d355019-13aa-41fc-a530-31d5f968ba22.json
-2024-12-14 15:07:35,920 - INFO - problem_instance UUID: 6d355019-13aa-41fc-a530-31d5f968ba22
-2024-12-14 15:07:35,920 - INFO - problem_instance short name: li_h_0
-2024-12-14 15:07:35,920 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:07:35,935 - INFO - Analyzing task 92917287-d937-410c-bb70-c1f34224fab7...
-2024-12-14 15:07:35,935 - INFO - number of supporting files: 2
-2024-12-14 15:07:35,935 - INFO - supporting data file UUID: 9c6f0876-5690-4391-a98c-0347d111257e.
-2024-12-14 15:07:35,935 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz.
-2024-12-14 15:07:35,935 - INFO - assuming fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz is an FCIDUMP file.
-2024-12-14 15:07:35,935 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz...
-2024-12-14 15:07:35,941 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:07:36,603 - INFO - Authentication (publickey) successful!
-2024-12-14 15:07:36,617 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:07:36,684 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:07:36,733 - INFO - ===============================================
-2024-12-14 15:07:36,733 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:07:59,779 - INFO - Circuit initialization time: 23.045662 seconds.
-2024-12-14 15:07:59,779 - INFO - Estimating logical resources...
-2024-12-14 15:08:05,079 - INFO - Resource estimation time (seconds): 5.299925
-2024-12-14 15:08:05,079 - INFO - supporting data file UUID: 0be93350-ebd5-4fd0-bbbe-029a7cc7681b.
-2024-12-14 15:08:05,079 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVDZ.0be93350-ebd5-4fd0-bbbe-029a7cc7681b.chk.
-2024-12-14 15:08:05,080 - INFO - assuming li_h_cc-pVDZ.0be93350-ebd5-4fd0-bbbe-029a7cc7681b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:08:05,080 - INFO - Analyzing task 13b4bdcc-1cef-419a-92b1-156febff71d4...
-2024-12-14 15:08:05,080 - INFO - number of supporting files: 2
-2024-12-14 15:08:05,080 - INFO - supporting data file UUID: c21d87dd-9338-4498-8ed6-95b0dacd75b1.
-2024-12-14 15:08:05,080 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz.
-2024-12-14 15:08:05,080 - INFO - assuming fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz is an FCIDUMP file.
-2024-12-14 15:08:05,080 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz...
-2024-12-14 15:08:05,084 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:08:05,755 - INFO - Authentication (publickey) successful!
-2024-12-14 15:08:05,772 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:08:17,028 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:08:29,685 - INFO - Skipping Logical Resource Estimate because number of orbitals (85) exceeds maximum specified in config (32).
-2024-12-14 15:08:29,685 - INFO - supporting data file UUID: 10693a03-698b-416a-80c0-dd563193c1d4.
-2024-12-14 15:08:29,685 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVQZ.10693a03-698b-416a-80c0-dd563193c1d4.chk.
-2024-12-14 15:08:29,685 - INFO - assuming li_h_cc-pVQZ.10693a03-698b-416a-80c0-dd563193c1d4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:08:29,685 - INFO - Analyzing task d15db194-aa2d-4de9-8f86-fcffeb82f38b...
-2024-12-14 15:08:29,686 - INFO - number of supporting files: 2
-2024-12-14 15:08:29,686 - INFO - supporting data file UUID: 02d12f52-ff42-4adf-99b9-acada93cb96b.
-2024-12-14 15:08:29,686 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz.
-2024-12-14 15:08:29,686 - INFO - assuming fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz is an FCIDUMP file.
-2024-12-14 15:08:29,686 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz...
-2024-12-14 15:08:29,692 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:08:30,343 - INFO - Authentication (publickey) successful!
-2024-12-14 15:08:30,357 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:08:30,524 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:08:31,880 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 15:08:31,880 - INFO - supporting data file UUID: 17337d1b-d2a5-4121-bf4a-d7236edd5c05.
-2024-12-14 15:08:31,880 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVTZ.17337d1b-d2a5-4121-bf4a-d7236edd5c05.chk.
-2024-12-14 15:08:31,880 - INFO - assuming li_h_cc-pVTZ.17337d1b-d2a5-4121-bf4a-d7236edd5c05.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:08:31,882 - INFO - parsing ../problem_instances/problem_instance.li2_0.3301a356-21a9-472b-8021-f02f4d2c9eec.json
-2024-12-14 15:08:31,883 - INFO - problem_instance UUID: 3301a356-21a9-472b-8021-f02f4d2c9eec
-2024-12-14 15:08:31,883 - INFO - problem_instance short name: li2_0
-2024-12-14 15:08:31,883 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:08:31,898 - INFO - Analyzing task e7d3b8bd-ff6c-44f6-8a9e-b9b75396cee0...
-2024-12-14 15:08:31,898 - INFO - number of supporting files: 2
-2024-12-14 15:08:31,898 - INFO - supporting data file UUID: 243670ee-2d2e-4d90-abc1-16938a04a80b.
-2024-12-14 15:08:31,898 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz.
-2024-12-14 15:08:31,898 - INFO - assuming fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz is an FCIDUMP file.
-2024-12-14 15:08:31,898 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz...
-2024-12-14 15:08:31,903 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:08:32,564 - INFO - Authentication (publickey) successful!
-2024-12-14 15:08:32,579 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:08:32,648 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:08:32,797 - INFO - ===============================================
-2024-12-14 15:08:32,797 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:09:58,807 - INFO - Circuit initialization time: 86.009777 seconds.
-2024-12-14 15:09:58,807 - INFO - Estimating logical resources...
-2024-12-14 15:10:15,339 - INFO - Resource estimation time (seconds): 16.531839
-2024-12-14 15:10:15,340 - INFO - supporting data file UUID: 948cb44e-e229-4be7-ba48-8ee73e042a6a.
-2024-12-14 15:10:15,340 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVDZ.948cb44e-e229-4be7-ba48-8ee73e042a6a.chk.
-2024-12-14 15:10:15,340 - INFO - assuming li2_cc-pVDZ.948cb44e-e229-4be7-ba48-8ee73e042a6a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:10:15,340 - INFO - Analyzing task aaa24a30-ade6-44a6-b6aa-51bf54c31eef...
-2024-12-14 15:10:15,340 - INFO - number of supporting files: 2
-2024-12-14 15:10:15,340 - INFO - supporting data file UUID: 6224abe8-831e-4b52-b8d9-8ebac0a35c2b.
-2024-12-14 15:10:15,340 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz.
-2024-12-14 15:10:15,340 - INFO - assuming fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz is an FCIDUMP file.
-2024-12-14 15:10:15,340 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz...
-2024-12-14 15:10:15,345 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:10:15,994 - INFO - Authentication (publickey) successful!
-2024-12-14 15:10:16,009 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:10:43,086 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:11:07,696 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 15:11:07,696 - INFO - supporting data file UUID: 2c2461b8-9343-4405-a3d5-aadd0a6cdac9.
-2024-12-14 15:11:07,696 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVQZ.2c2461b8-9343-4405-a3d5-aadd0a6cdac9.chk.
-2024-12-14 15:11:07,696 - INFO - assuming li2_cc-pVQZ.2c2461b8-9343-4405-a3d5-aadd0a6cdac9.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:11:07,696 - INFO - Analyzing task 410cd417-988a-4f7f-99ad-93dda7eacdcb...
-2024-12-14 15:11:07,696 - INFO - number of supporting files: 2
-2024-12-14 15:11:07,696 - INFO - supporting data file UUID: 26d2547c-96a4-400d-9528-9987ae6699b2.
-2024-12-14 15:11:07,696 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz.
-2024-12-14 15:11:07,696 - INFO - assuming fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz is an FCIDUMP file.
-2024-12-14 15:11:07,696 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz...
-2024-12-14 15:11:07,701 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:11:08,361 - INFO - Authentication (publickey) successful!
-2024-12-14 15:11:08,376 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:11:08,694 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:11:11,500 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 15:11:11,500 - INFO - supporting data file UUID: e51ca409-0d43-4958-b89d-b0a3906c91d5.
-2024-12-14 15:11:11,500 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVTZ.e51ca409-0d43-4958-b89d-b0a3906c91d5.chk.
-2024-12-14 15:11:11,500 - INFO - assuming li2_cc-pVTZ.e51ca409-0d43-4958-b89d-b0a3906c91d5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:11:11,502 - INFO - parsing ../problem_instances/problem_instance.h_f_0.892e3341-7186-44c6-9a1a-20f270ddc8b8.json
-2024-12-14 15:11:11,502 - INFO - problem_instance UUID: 892e3341-7186-44c6-9a1a-20f270ddc8b8
-2024-12-14 15:11:11,502 - INFO - problem_instance short name: h_f_0
-2024-12-14 15:11:11,502 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:11:11,517 - INFO - Analyzing task b59bd259-4941-4cec-bca5-e2795c35d8e0...
-2024-12-14 15:11:11,517 - INFO - number of supporting files: 2
-2024-12-14 15:11:11,518 - INFO - supporting data file UUID: b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.
-2024-12-14 15:11:11,518 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz.
-2024-12-14 15:11:11,518 - INFO - assuming fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz is an FCIDUMP file.
-2024-12-14 15:11:11,518 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz...
-2024-12-14 15:11:11,525 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:11:12,187 - INFO - Authentication (publickey) successful!
-2024-12-14 15:11:12,203 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:11:12,261 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:11:12,312 - INFO - ===============================================
-2024-12-14 15:11:12,312 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:11:35,473 - INFO - Circuit initialization time: 23.161137 seconds.
-2024-12-14 15:11:35,473 - INFO - Estimating logical resources...
-2024-12-14 15:11:40,715 - INFO - Resource estimation time (seconds): 5.241502
-2024-12-14 15:11:40,715 - INFO - supporting data file UUID: 3bb657ac-2131-4ee7-9859-9e4ff876245a.
-2024-12-14 15:11:40,715 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVDZ.3bb657ac-2131-4ee7-9859-9e4ff876245a.chk.
-2024-12-14 15:11:40,715 - INFO - assuming h_f_cc-pVDZ.3bb657ac-2131-4ee7-9859-9e4ff876245a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:11:40,715 - INFO - Analyzing task 9e3c577f-a25d-42f5-a809-61dfb63a52de...
-2024-12-14 15:11:40,715 - INFO - number of supporting files: 2
-2024-12-14 15:11:40,715 - INFO - supporting data file UUID: ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.
-2024-12-14 15:11:40,715 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz.
-2024-12-14 15:11:40,715 - INFO - assuming fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz is an FCIDUMP file.
-2024-12-14 15:11:40,715 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz...
-2024-12-14 15:11:40,721 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:11:41,383 - INFO - Authentication (publickey) successful!
-2024-12-14 15:11:41,401 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:11:52,353 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:12:11,014 - INFO - Skipping Logical Resource Estimate because number of orbitals (85) exceeds maximum specified in config (32).
-2024-12-14 15:12:11,014 - INFO - supporting data file UUID: ddc246a3-9770-4542-8cfd-74afbff4e7a0.
-2024-12-14 15:12:11,014 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVQZ.ddc246a3-9770-4542-8cfd-74afbff4e7a0.chk.
-2024-12-14 15:12:11,014 - INFO - assuming h_f_cc-pVQZ.ddc246a3-9770-4542-8cfd-74afbff4e7a0.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:12:11,014 - INFO - Analyzing task daa86ad6-bda9-4d47-a50d-4ec34801bd82...
-2024-12-14 15:12:11,014 - INFO - number of supporting files: 2
-2024-12-14 15:12:11,014 - INFO - supporting data file UUID: 819ffa8e-51ee-4e78-aa07-17686d7a9488.
-2024-12-14 15:12:11,015 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz.
-2024-12-14 15:12:11,015 - INFO - assuming fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz is an FCIDUMP file.
-2024-12-14 15:12:11,015 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz...
-2024-12-14 15:12:11,020 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:12:11,661 - INFO - Authentication (publickey) successful!
-2024-12-14 15:12:11,678 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:12:11,850 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:12:13,384 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 15:12:13,384 - INFO - supporting data file UUID: 7369a736-b751-4ace-a057-7f6a07194ffa.
-2024-12-14 15:12:13,384 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVTZ.7369a736-b751-4ace-a057-7f6a07194ffa.chk.
-2024-12-14 15:12:13,384 - INFO - assuming h_f_cc-pVTZ.7369a736-b751-4ace-a057-7f6a07194ffa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:12:13,386 - INFO - parsing ../problem_instances/problem_instance.Fe_0.05abb33d-ecea-406f-8832-31a814b26dfd.json
-2024-12-14 15:12:13,387 - INFO - problem_instance UUID: 05abb33d-ecea-406f-8832-31a814b26dfd
-2024-12-14 15:12:13,387 - INFO - problem_instance short name: Fe_0
-2024-12-14 15:12:13,387 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:12:13,402 - INFO - Analyzing task 5b8f4746-a08b-4ec5-92e2-ce55cc2fdb75...
-2024-12-14 15:12:13,402 - INFO - number of supporting files: 2
-2024-12-14 15:12:13,403 - INFO - supporting data file UUID: 133ec573-3d06-4582-b2f5-8afe8be8dbe3.
-2024-12-14 15:12:13,403 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz.
-2024-12-14 15:12:13,403 - INFO - assuming fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz is an FCIDUMP file.
-2024-12-14 15:12:13,403 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz...
-2024-12-14 15:12:13,407 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:12:14,077 - INFO - Authentication (publickey) successful!
-2024-12-14 15:12:14,093 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:12:16,236 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:12:23,627 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:12:23,627 - INFO - supporting data file UUID: 6644ed13-743e-4f98-8ab9-6c2abf88d032.
-2024-12-14 15:12:23,627 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe0_vdz.6644ed13-743e-4f98-8ab9-6c2abf88d032.chk.
-2024-12-14 15:12:23,627 - INFO - assuming Fe0_vdz.6644ed13-743e-4f98-8ab9-6c2abf88d032.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:12:23,627 - INFO - Analyzing task c63f5f9b-ee73-4887-949b-dd1e74c31874...
-2024-12-14 15:12:23,627 - INFO - number of supporting files: 2
-2024-12-14 15:12:23,627 - INFO - supporting data file UUID: cb274492-6acb-4426-a4f6-8cb4a8cef3c5.
-2024-12-14 15:12:23,627 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz.
-2024-12-14 15:12:23,627 - INFO - assuming fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz is an FCIDUMP file.
-2024-12-14 15:12:23,627 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz...
-2024-12-14 15:12:23,632 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:12:24,283 - INFO - Authentication (publickey) successful!
-2024-12-14 15:12:24,298 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:13:55,469 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:14:46,130 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 15:14:46,130 - INFO - supporting data file UUID: 9d520d39-2e21-4294-8d58-af6d068b38de.
-2024-12-14 15:14:46,130 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe0_vtz.9d520d39-2e21-4294-8d58-af6d068b38de.chk.
-2024-12-14 15:14:46,130 - INFO - assuming Fe0_vtz.9d520d39-2e21-4294-8d58-af6d068b38de.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:14:46,135 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0010.bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8.json
-2024-12-14 15:14:46,135 - INFO - problem_instance UUID: bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8
-2024-12-14 15:14:46,135 - INFO - problem_instance short name: planted_solution_0010
-2024-12-14 15:14:46,135 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:14:46,151 - INFO - Analyzing task 7cc1ed5c-0dcb-4315-9e51-2ae94b5cdd02...
-2024-12-14 15:14:46,151 - INFO - number of supporting files: 1
-2024-12-14 15:14:46,151 - INFO - supporting data file UUID: eea867d0-285e-462d-94ab-15579c782be7.
-2024-12-14 15:14:46,151 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz.
-2024-12-14 15:14:46,151 - INFO - assuming fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz is an FCIDUMP file.
-2024-12-14 15:14:46,151 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz...
-2024-12-14 15:14:46,156 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:14:46,769 - INFO - Authentication (publickey) successful!
-2024-12-14 15:14:46,784 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:14:46,861 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:14:47,187 - INFO - ===============================================
-2024-12-14 15:14:47,187 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:17:35,624 - INFO - Circuit initialization time: 168.436994 seconds.
-2024-12-14 15:17:35,625 - INFO - Estimating logical resources...
-2024-12-14 15:17:41,872 - INFO - Resource estimation time (seconds): 6.246897
-2024-12-14 15:17:41,874 - INFO - parsing ../problem_instances/problem_instance.ru_macho.b78a10f2-ce8a-43c0-69ec-4cf666d8e85c.json
-2024-12-14 15:17:41,875 - INFO - problem_instance UUID: b78a10f2-ce8a-43c0-69ec-4cf666d8e85c
-2024-12-14 15:17:41,875 - INFO - problem_instance short name: ru_macho
-2024-12-14 15:17:41,875 - INFO - contains 9 associated Hamiltonians.
-2024-12-14 15:17:41,891 - INFO - Analyzing task 4357d5bb-ed2b-466a-947b-e868afb81d3d...
-2024-12-14 15:17:41,891 - INFO - number of supporting files: 1
-2024-12-14 15:17:41,891 - INFO - supporting data file UUID: 1dc29784-ab7f-45a1-9821-31fea4363d74.
-2024-12-14 15:17:41,891 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz.
-2024-12-14 15:17:41,891 - INFO - assuming fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz is an FCIDUMP file.
-2024-12-14 15:17:41,891 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz...
-2024-12-14 15:17:41,896 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:17:42,400 - INFO - Authentication (publickey) successful!
-2024-12-14 15:17:42,416 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:17:42,473 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:17:42,474 - INFO - ===============================================
-2024-12-14 15:17:42,474 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:17:44,127 - INFO - Circuit initialization time: 1.65235 seconds.
-2024-12-14 15:17:44,127 - INFO - Estimating logical resources...
-2024-12-14 15:17:44,660 - INFO - Resource estimation time (seconds): 0.533004
-2024-12-14 15:17:44,660 - INFO - Analyzing task b164af91-a758-445c-8e78-610ffd2ad795...
-2024-12-14 15:17:44,660 - INFO - number of supporting files: 1
-2024-12-14 15:17:44,660 - INFO - supporting data file UUID: 5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.
-2024-12-14 15:17:44,661 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz.
-2024-12-14 15:17:44,661 - INFO - assuming fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz is an FCIDUMP file.
-2024-12-14 15:17:44,661 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz...
-2024-12-14 15:17:44,666 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:17:45,339 - INFO - Authentication (publickey) successful!
-2024-12-14 15:17:45,354 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:17:45,405 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:17:45,410 - INFO - ===============================================
-2024-12-14 15:17:45,410 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:17:48,653 - INFO - Circuit initialization time: 3.242435 seconds.
-2024-12-14 15:17:48,653 - INFO - Estimating logical resources...
-2024-12-14 15:17:49,857 - INFO - Resource estimation time (seconds): 1.204043
-2024-12-14 15:17:49,857 - INFO - Analyzing task 28bd4997-c04c-4914-9984-0101713041fe...
-2024-12-14 15:17:49,857 - INFO - number of supporting files: 1
-2024-12-14 15:17:49,857 - INFO - supporting data file UUID: 587f69a8-4295-4d6d-811e-0eacfbc5f6dd.
-2024-12-14 15:17:49,857 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz.
-2024-12-14 15:17:49,857 - INFO - assuming fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz is an FCIDUMP file.
-2024-12-14 15:17:49,858 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz...
-2024-12-14 15:17:49,862 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:17:50,543 - INFO - Authentication (publickey) successful!
-2024-12-14 15:17:50,558 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:17:50,619 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:17:50,637 - INFO - ===============================================
-2024-12-14 15:17:50,638 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:18:02,239 - INFO - Circuit initialization time: 11.601499 seconds.
-2024-12-14 15:18:02,240 - INFO - Estimating logical resources...
-2024-12-14 15:18:05,423 - INFO - Resource estimation time (seconds): 3.18328
-2024-12-14 15:18:05,423 - INFO - Analyzing task dcf2b441-b297-4a89-ae18-5778ec2d674d...
-2024-12-14 15:18:05,423 - INFO - number of supporting files: 1
-2024-12-14 15:18:05,423 - INFO - supporting data file UUID: 46aea10c-d57f-4133-9837-3c57d474d9a2.
-2024-12-14 15:18:05,423 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz.
-2024-12-14 15:18:05,423 - INFO - assuming fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz is an FCIDUMP file.
-2024-12-14 15:18:05,424 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz...
-2024-12-14 15:18:05,428 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:18:06,081 - INFO - Authentication (publickey) successful!
-2024-12-14 15:18:06,096 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:18:06,154 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:18:06,165 - INFO - ===============================================
-2024-12-14 15:18:06,166 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:18:13,270 - INFO - Circuit initialization time: 7.104375 seconds.
-2024-12-14 15:18:13,270 - INFO - Estimating logical resources...
-2024-12-14 15:18:15,337 - INFO - Resource estimation time (seconds): 2.06686
-2024-12-14 15:18:15,337 - INFO - Analyzing task 6346b7fe-a4a5-4b10-a79b-706d4339923e...
-2024-12-14 15:18:15,337 - INFO - number of supporting files: 1
-2024-12-14 15:18:15,337 - INFO - supporting data file UUID: 496aaf89-2cdf-43cf-8b25-246e915cc8b5.
-2024-12-14 15:18:15,337 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz.
-2024-12-14 15:18:15,338 - INFO - assuming fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz is an FCIDUMP file.
-2024-12-14 15:18:15,338 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz...
-2024-12-14 15:18:15,342 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:18:15,990 - INFO - Authentication (publickey) successful!
-2024-12-14 15:18:16,008 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:18:16,104 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:18:16,636 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 15:18:16,636 - INFO - Analyzing task 68db6781-dd54-43c4-b667-7b754c4d5cdb...
-2024-12-14 15:18:16,637 - INFO - number of supporting files: 1
-2024-12-14 15:18:16,637 - INFO - supporting data file UUID: 0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.
-2024-12-14 15:18:16,637 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz.
-2024-12-14 15:18:16,637 - INFO - assuming fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz is an FCIDUMP file.
-2024-12-14 15:18:16,637 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz...
-2024-12-14 15:18:16,642 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:18:17,311 - INFO - Authentication (publickey) successful!
-2024-12-14 15:18:17,326 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:18:17,404 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:18:17,536 - INFO - ===============================================
-2024-12-14 15:18:17,536 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:19:36,349 - INFO - Circuit initialization time: 78.812818 seconds.
-2024-12-14 15:19:36,349 - INFO - Estimating logical resources...
-2024-12-14 15:19:49,982 - INFO - Resource estimation time (seconds): 13.632504
-2024-12-14 15:19:49,982 - INFO - Analyzing task d3ecd428-ee03-4d8b-aa14-af4d935781ed...
-2024-12-14 15:19:49,982 - INFO - number of supporting files: 1
-2024-12-14 15:19:49,982 - INFO - supporting data file UUID: e5e63f77-dbaa-431c-a53f-93c0f4c0758d.
-2024-12-14 15:19:49,982 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz.
-2024-12-14 15:19:49,982 - INFO - assuming fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz is an FCIDUMP file.
-2024-12-14 15:19:49,982 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz...
-2024-12-14 15:19:49,987 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:19:50,647 - INFO - Authentication (publickey) successful!
-2024-12-14 15:19:50,663 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:19:51,052 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:19:52,844 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 15:19:52,845 - INFO - Analyzing task 89253c8f-0f01-4046-a138-1bada22f0a6a...
-2024-12-14 15:19:52,845 - INFO - number of supporting files: 1
-2024-12-14 15:19:52,845 - INFO - supporting data file UUID: d7bea809-6e34-49f8-8daf-8d728dd18268.
-2024-12-14 15:19:52,845 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz.
-2024-12-14 15:19:52,845 - INFO - assuming fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz is an FCIDUMP file.
-2024-12-14 15:19:52,845 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz...
-2024-12-14 15:19:52,850 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:19:53,505 - INFO - Authentication (publickey) successful!
-2024-12-14 15:19:53,521 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:19:53,574 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:19:53,664 - INFO - ===============================================
-2024-12-14 15:19:53,664 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:20:44,796 - INFO - Circuit initialization time: 51.132174 seconds.
-2024-12-14 15:20:44,796 - INFO - Estimating logical resources...
-2024-12-14 15:20:55,114 - INFO - Resource estimation time (seconds): 10.317261
-2024-12-14 15:20:55,114 - INFO - Analyzing task 842d2152-2f91-4dce-b088-7ed26afb2381...
-2024-12-14 15:20:55,114 - INFO - number of supporting files: 1
-2024-12-14 15:20:55,114 - INFO - supporting data file UUID: 73ae455f-a729-4fac-a626-5654b03c1ef5.
-2024-12-14 15:20:55,114 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz.
-2024-12-14 15:20:55,114 - INFO - assuming fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz is an FCIDUMP file.
-2024-12-14 15:20:55,114 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz...
-2024-12-14 15:20:55,119 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:20:55,783 - INFO - Authentication (publickey) successful!
-2024-12-14 15:20:55,799 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:20:55,949 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:20:57,295 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 15:20:57,297 - INFO - parsing ../problem_instances/problem_instance.Cu_1.d5c7ab73-dfc1-499e-9027-601476004107.json
-2024-12-14 15:20:57,298 - INFO - problem_instance UUID: d5c7ab73-dfc1-499e-9027-601476004107
-2024-12-14 15:20:57,298 - INFO - problem_instance short name: Cu_1
-2024-12-14 15:20:57,298 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:20:57,313 - INFO - Analyzing task 5f5fee92-5821-4d38-a54a-d204660f205f...
-2024-12-14 15:20:57,313 - INFO - number of supporting files: 2
-2024-12-14 15:20:57,313 - INFO - supporting data file UUID: 6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.
-2024-12-14 15:20:57,313 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz.
-2024-12-14 15:20:57,313 - INFO - assuming fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz is an FCIDUMP file.
-2024-12-14 15:20:57,313 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz...
-2024-12-14 15:20:57,319 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:20:57,816 - INFO - Authentication (publickey) successful!
-2024-12-14 15:20:57,830 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:20:58,393 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:21:02,089 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:21:02,089 - INFO - supporting data file UUID: 36737c9f-2f69-4963-91a1-daf7a2a3fcfd.
-2024-12-14 15:21:02,089 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu1_vdz.36737c9f-2f69-4963-91a1-daf7a2a3fcfd.chk.
-2024-12-14 15:21:02,090 - INFO - assuming Cu1_vdz.36737c9f-2f69-4963-91a1-daf7a2a3fcfd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:21:02,090 - INFO - Analyzing task 1c7f5399-8982-4daf-81a5-7cef4e4588cc...
-2024-12-14 15:21:02,090 - INFO - number of supporting files: 2
-2024-12-14 15:21:02,090 - INFO - supporting data file UUID: 68952c71-d281-40fa-bcd2-cb0352f70a89.
-2024-12-14 15:21:02,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz.
-2024-12-14 15:21:02,090 - INFO - assuming fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz is an FCIDUMP file.
-2024-12-14 15:21:02,090 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz...
-2024-12-14 15:21:02,095 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:21:02,753 - INFO - Authentication (publickey) successful!
-2024-12-14 15:21:02,768 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:21:24,960 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:21:50,009 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 15:21:50,010 - INFO - supporting data file UUID: d9bbc858-2cef-43ee-896f-c9059d2b13b5.
-2024-12-14 15:21:50,010 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu1_vtz.d9bbc858-2cef-43ee-896f-c9059d2b13b5.chk.
-2024-12-14 15:21:50,010 - INFO - assuming Cu1_vtz.d9bbc858-2cef-43ee-896f-c9059d2b13b5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:21:50,011 - INFO - parsing ../problem_instances/problem_instance.n_h3_0.127cfea5-8a7d-45a0-9012-949816a0b8d9.json
-2024-12-14 15:21:50,012 - INFO - problem_instance UUID: 127cfea5-8a7d-45a0-9012-949816a0b8d9
-2024-12-14 15:21:50,012 - INFO - problem_instance short name: n_h3_0
-2024-12-14 15:21:50,012 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:21:50,027 - INFO - Analyzing task 77c3a92c-066c-4043-a4a1-5e8324014d0b...
-2024-12-14 15:21:50,027 - INFO - number of supporting files: 2
-2024-12-14 15:21:50,028 - INFO - supporting data file UUID: 9820e181-088a-4b00-8a14-8cafb952ccdd.
-2024-12-14 15:21:50,028 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz.
-2024-12-14 15:21:50,028 - INFO - assuming fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz is an FCIDUMP file.
-2024-12-14 15:21:50,028 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz...
-2024-12-14 15:21:50,038 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:21:50,676 - INFO - Authentication (publickey) successful!
-2024-12-14 15:21:50,690 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:21:50,770 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:21:51,134 - INFO - ===============================================
-2024-12-14 15:21:51,134 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:24:41,982 - INFO - Circuit initialization time: 170.848081 seconds.
-2024-12-14 15:24:41,982 - INFO - Estimating logical resources...
-2024-12-14 15:25:08,949 - INFO - Resource estimation time (seconds): 26.96626
-2024-12-14 15:25:08,949 - INFO - supporting data file UUID: e3cda046-ae0d-47d9-b012-7f1e5f632f71.
-2024-12-14 15:25:08,949 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n_h3_cc-pVDZ.e3cda046-ae0d-47d9-b012-7f1e5f632f71.chk.
-2024-12-14 15:25:08,949 - INFO - assuming n_h3_cc-pVDZ.e3cda046-ae0d-47d9-b012-7f1e5f632f71.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:25:08,949 - INFO - Analyzing task 1094e868-f84e-403b-9b54-50802b1cdb60...
-2024-12-14 15:25:08,949 - INFO - number of supporting files: 2
-2024-12-14 15:25:08,949 - INFO - supporting data file UUID: 3b423f54-aa64-4331-a59b-d6c37de1fbb6.
-2024-12-14 15:25:08,949 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz.
-2024-12-14 15:25:08,949 - INFO - assuming fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz is an FCIDUMP file.
-2024-12-14 15:25:08,949 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz...
-2024-12-14 15:25:08,954 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:25:09,626 - INFO - Authentication (publickey) successful!
-2024-12-14 15:25:09,646 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:25:41,888 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:25:56,632 - INFO - Skipping Logical Resource Estimate because number of orbitals (72) exceeds maximum specified in config (32).
-2024-12-14 15:25:56,633 - INFO - supporting data file UUID: 15125674-abf8-4db2-9db6-9d293b677584.
-2024-12-14 15:25:56,633 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n_h3_cc-pVTZ.15125674-abf8-4db2-9db6-9d293b677584.chk.
-2024-12-14 15:25:56,633 - INFO - assuming n_h3_cc-pVTZ.15125674-abf8-4db2-9db6-9d293b677584.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:25:56,635 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0006.42958a3e-8b35-4992-acd8-6711848066c1.json
-2024-12-14 15:25:56,635 - INFO - problem_instance UUID: 42958a3e-8b35-4992-acd8-6711848066c1
-2024-12-14 15:25:56,635 - INFO - problem_instance short name: planted_solution_0006
-2024-12-14 15:25:56,635 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:25:56,651 - INFO - Analyzing task d28f02ba-d43f-4df9-a01a-f1e8ac326e08...
-2024-12-14 15:25:56,651 - INFO - number of supporting files: 1
-2024-12-14 15:25:56,651 - INFO - supporting data file UUID: a4b9a6bd-4479-44b2-b172-642f74396781.
-2024-12-14 15:25:56,651 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz.
-2024-12-14 15:25:56,651 - INFO - assuming fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz is an FCIDUMP file.
-2024-12-14 15:25:56,651 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz...
-2024-12-14 15:25:56,657 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:25:57,154 - INFO - Authentication (publickey) successful!
-2024-12-14 15:25:57,202 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:25:57,268 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:25:57,288 - INFO - ===============================================
-2024-12-14 15:25:57,288 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:26:06,758 - INFO - Circuit initialization time: 9.469449 seconds.
-2024-12-14 15:26:06,758 - INFO - Estimating logical resources...
-2024-12-14 15:26:08,290 - INFO - Resource estimation time (seconds): 1.53208
-2024-12-14 15:26:08,292 - INFO - parsing ../problem_instances/problem_instance.n2_h4_0.f1a6b508-75e8-4afb-9c81-fc61af11b523.json
-2024-12-14 15:26:08,293 - INFO - problem_instance UUID: f1a6b508-75e8-4afb-9c81-fc61af11b523
-2024-12-14 15:26:08,293 - INFO - problem_instance short name: n2_h4_0
-2024-12-14 15:26:08,293 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:26:08,307 - INFO - Analyzing task 828c931b-4d5a-486e-ba26-abb293c1ccef...
-2024-12-14 15:26:08,308 - INFO - number of supporting files: 2
-2024-12-14 15:26:08,308 - INFO - supporting data file UUID: aba33661-3ce8-4f28-824f-e98244906d94.
-2024-12-14 15:26:08,308 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz.
-2024-12-14 15:26:08,308 - INFO - assuming fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz is an FCIDUMP file.
-2024-12-14 15:26:08,308 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz...
-2024-12-14 15:26:08,314 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:26:08,951 - INFO - Authentication (publickey) successful!
-2024-12-14 15:26:08,966 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:26:10,922 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:26:15,596 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 15:26:15,596 - INFO - supporting data file UUID: 93193d14-3f99-4495-bcf8-e60f9d863904.
-2024-12-14 15:26:15,596 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_h4_cc-pVDZ.93193d14-3f99-4495-bcf8-e60f9d863904.chk.
-2024-12-14 15:26:15,596 - INFO - assuming n2_h4_cc-pVDZ.93193d14-3f99-4495-bcf8-e60f9d863904.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:26:15,598 - INFO - parsing ../problem_instances/problem_instance.c2_h4_0.9fbd9b4c-5ea9-4095-af7b-7d4491399e42.json
-2024-12-14 15:26:15,598 - INFO - problem_instance UUID: 9fbd9b4c-5ea9-4095-af7b-7d4491399e42
-2024-12-14 15:26:15,598 - INFO - problem_instance short name: c2_h4_0
-2024-12-14 15:26:15,598 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:26:15,613 - INFO - Analyzing task 26423f2e-e3e1-4bbb-b2ff-52bdae87d65b...
-2024-12-14 15:26:15,614 - INFO - number of supporting files: 2
-2024-12-14 15:26:15,614 - INFO - supporting data file UUID: 40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.
-2024-12-14 15:26:15,614 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz.
-2024-12-14 15:26:15,614 - INFO - assuming fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz is an FCIDUMP file.
-2024-12-14 15:26:15,614 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz...
-2024-12-14 15:26:15,619 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:26:16,343 - INFO - Authentication (publickey) successful!
-2024-12-14 15:26:16,359 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:26:17,293 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:26:18,919 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 15:26:18,919 - INFO - supporting data file UUID: f563c847-e680-4452-8320-aa3b4e8aa3b7.
-2024-12-14 15:26:18,919 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h4_cc-pVDZ.f563c847-e680-4452-8320-aa3b4e8aa3b7.chk.
-2024-12-14 15:26:18,919 - INFO - assuming c2_h4_cc-pVDZ.f563c847-e680-4452-8320-aa3b4e8aa3b7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:26:18,919 - INFO - Analyzing task 9757b7c2-d420-4ebb-8da7-38238951a5ca...
-2024-12-14 15:26:18,919 - INFO - number of supporting files: 2
-2024-12-14 15:26:18,919 - INFO - supporting data file UUID: 4bd40563-25e1-4334-bf15-3ccd36c05ab2.
-2024-12-14 15:26:18,919 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz.
-2024-12-14 15:26:18,919 - INFO - assuming fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz is an FCIDUMP file.
-2024-12-14 15:26:18,919 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz...
-2024-12-14 15:26:19,002 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:26:19,657 - INFO - Authentication (publickey) successful!
-2024-12-14 15:26:19,673 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:27:58,090 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:28:44,660 - INFO - Skipping Logical Resource Estimate because number of orbitals (116) exceeds maximum specified in config (32).
-2024-12-14 15:28:44,660 - INFO - supporting data file UUID: d4db7859-f494-41d7-8658-56dcb50831b4.
-2024-12-14 15:28:44,660 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h4_cc-pVTZ.d4db7859-f494-41d7-8658-56dcb50831b4.chk.
-2024-12-14 15:28:44,660 - INFO - assuming c2_h4_cc-pVTZ.d4db7859-f494-41d7-8658-56dcb50831b4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:28:44,674 - INFO - parsing ../problem_instances/problem_instance.O_1.d712afaf-6ec4-42d9-b5fd-1edee3ec1046.json
-2024-12-14 15:28:44,674 - INFO - problem_instance UUID: d712afaf-6ec4-42d9-b5fd-1edee3ec1046
-2024-12-14 15:28:44,674 - INFO - problem_instance short name: O_1
-2024-12-14 15:28:44,674 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:28:44,686 - INFO - Analyzing task 752966e5-7de7-4506-82ae-6b22cd54b1c1...
-2024-12-14 15:28:44,686 - INFO - number of supporting files: 2
-2024-12-14 15:28:44,686 - INFO - supporting data file UUID: 0767fb16-25bd-4f1c-b134-6b536191b36e.
-2024-12-14 15:28:44,686 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz.
-2024-12-14 15:28:44,686 - INFO - assuming fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz is an FCIDUMP file.
-2024-12-14 15:28:44,686 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz...
-2024-12-14 15:28:44,692 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:28:45,357 - INFO - Authentication (publickey) successful!
-2024-12-14 15:28:45,373 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:28:45,439 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:28:45,548 - INFO - ===============================================
-2024-12-14 15:28:45,548 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:29:26,876 - INFO - Circuit initialization time: 41.327389 seconds.
-2024-12-14 15:29:26,876 - INFO - Estimating logical resources...
-2024-12-14 15:29:35,188 - INFO - Resource estimation time (seconds): 8.311919
-2024-12-14 15:29:35,188 - INFO - supporting data file UUID: db942588-339b-4fb6-a293-f853ebb812d7.
-2024-12-14 15:29:35,188 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vdz.db942588-339b-4fb6-a293-f853ebb812d7.chk.
-2024-12-14 15:29:35,188 - INFO - assuming O1_vdz.db942588-339b-4fb6-a293-f853ebb812d7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:29:35,189 - INFO - Analyzing task 64122cc6-e1bb-4c11-8d00-2189d27194f1...
-2024-12-14 15:29:35,189 - INFO - number of supporting files: 2
-2024-12-14 15:29:35,189 - INFO - supporting data file UUID: 3b587c2c-9579-4c7b-8b3f-e00c69c42981.
-2024-12-14 15:29:35,189 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz.
-2024-12-14 15:29:35,189 - INFO - assuming fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz is an FCIDUMP file.
-2024-12-14 15:29:35,189 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz...
-2024-12-14 15:29:35,193 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:29:35,826 - INFO - Authentication (publickey) successful!
-2024-12-14 15:29:35,844 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:29:46,200 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:30:02,298 - INFO - Skipping Logical Resource Estimate because number of orbitals (79) exceeds maximum specified in config (32).
-2024-12-14 15:30:02,298 - INFO - supporting data file UUID: 9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.
-2024-12-14 15:30:02,298 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vqz.9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.chk.
-2024-12-14 15:30:02,298 - INFO - assuming O1_vqz.9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:30:02,298 - INFO - Analyzing task f9bdbb3b-91b6-43f3-93ca-bef1e10d3835...
-2024-12-14 15:30:02,298 - INFO - number of supporting files: 2
-2024-12-14 15:30:02,298 - INFO - supporting data file UUID: ee1c9912-bca9-42fa-a90d-421e9a26c785.
-2024-12-14 15:30:02,298 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz.
-2024-12-14 15:30:02,298 - INFO - assuming fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz is an FCIDUMP file.
-2024-12-14 15:30:02,298 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz...
-2024-12-14 15:30:02,303 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:30:02,951 - INFO - Authentication (publickey) successful!
-2024-12-14 15:30:02,968 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:30:03,213 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:30:04,940 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 15:30:04,940 - INFO - supporting data file UUID: b295de3f-c1ac-42ed-baf4-97cc52e0dba2.
-2024-12-14 15:30:04,940 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vtz.b295de3f-c1ac-42ed-baf4-97cc52e0dba2.chk.
-2024-12-14 15:30:04,940 - INFO - assuming O1_vtz.b295de3f-c1ac-42ed-baf4-97cc52e0dba2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:30:04,942 - INFO - parsing ../problem_instances/problem_instance.cr_dimer.8ed1a800-a4c6-4bff-a6de-cb220554c42f.json
-2024-12-14 15:30:04,942 - INFO - problem_instance UUID: 8ed1a800-a4c6-4bff-a6de-cb220554c42f
-2024-12-14 15:30:04,942 - INFO - problem_instance short name: cr_dimer
-2024-12-14 15:30:04,942 - INFO - contains 12 associated Hamiltonians.
-2024-12-14 15:30:04,957 - INFO - Analyzing task 9030e9c9-0323-413c-a98e-aba16b180ba7...
-2024-12-14 15:30:04,957 - INFO - number of supporting files: 1
-2024-12-14 15:30:04,957 - INFO - supporting data file UUID: 3092dd74-660d-4c7a-9d43-16d1436e084b.
-2024-12-14 15:30:04,957 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz.
-2024-12-14 15:30:04,957 - INFO - assuming FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz is an FCIDUMP file.
-2024-12-14 15:30:04,957 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz...
-2024-12-14 15:30:04,962 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:30:05,622 - INFO - Authentication (publickey) successful!
-2024-12-14 15:30:05,641 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:30:05,700 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:30:05,753 - INFO - ===============================================
-2024-12-14 15:30:05,753 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:30:24,578 - INFO - Circuit initialization time: 18.825116 seconds.
-2024-12-14 15:30:24,579 - INFO - Estimating logical resources...
-2024-12-14 15:30:29,589 - INFO - Resource estimation time (seconds): 5.01002
-2024-12-14 15:30:29,589 - INFO - Analyzing task c7c653b0-4440-4a36-a66b-8b81a9a351c7...
-2024-12-14 15:30:29,589 - INFO - number of supporting files: 1
-2024-12-14 15:30:29,589 - INFO - supporting data file UUID: 96843098-e69d-4d1f-8a88-5b24826f7390.
-2024-12-14 15:30:29,589 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz.
-2024-12-14 15:30:29,589 - INFO - assuming FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz is an FCIDUMP file.
-2024-12-14 15:30:29,589 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz...
-2024-12-14 15:30:29,595 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:30:30,247 - INFO - Authentication (publickey) successful!
-2024-12-14 15:30:30,262 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:30:30,319 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:30:30,521 - INFO - ===============================================
-2024-12-14 15:30:30,521 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:31:47,904 - INFO - Circuit initialization time: 77.382228 seconds.
-2024-12-14 15:31:47,904 - INFO - Estimating logical resources...
-2024-12-14 15:32:03,450 - INFO - Resource estimation time (seconds): 15.546244
-2024-12-14 15:32:03,450 - INFO - Analyzing task 82f35801-6276-4090-a9aa-b821d94708d4...
-2024-12-14 15:32:03,450 - INFO - number of supporting files: 1
-2024-12-14 15:32:03,451 - INFO - supporting data file UUID: 673dfe91-d90e-4ecd-8560-d6d74de11070.
-2024-12-14 15:32:03,451 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz.
-2024-12-14 15:32:03,451 - INFO - assuming FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz is an FCIDUMP file.
-2024-12-14 15:32:03,451 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz...
-2024-12-14 15:32:03,458 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:32:04,124 - INFO - Authentication (publickey) successful!
-2024-12-14 15:32:04,146 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:32:07,373 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:32:16,969 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 15:32:16,969 - INFO - Analyzing task 362386c9-f0c2-483e-a64d-52208ab9bbc1...
-2024-12-14 15:32:16,969 - INFO - number of supporting files: 1
-2024-12-14 15:32:16,969 - INFO - supporting data file UUID: 4412b7d6-86db-4616-9dd2-2c32ee02560f.
-2024-12-14 15:32:16,969 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz.
-2024-12-14 15:32:16,969 - INFO - assuming FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz is an FCIDUMP file.
-2024-12-14 15:32:16,969 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz...
-2024-12-14 15:32:16,976 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:32:17,685 - INFO - Authentication (publickey) successful!
-2024-12-14 15:32:17,701 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:32:27,065 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:32:41,660 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 15:32:41,660 - INFO - Analyzing task 61ad4cfe-b057-4dd8-bd06-ed56347745c1...
-2024-12-14 15:32:41,660 - INFO - number of supporting files: 1
-2024-12-14 15:32:41,660 - INFO - supporting data file UUID: cdf017c4-7c30-4274-9567-f5e55a6ba857.
-2024-12-14 15:32:41,660 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz.
-2024-12-14 15:32:41,660 - INFO - assuming FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz is an FCIDUMP file.
-2024-12-14 15:32:41,660 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz...
-2024-12-14 15:32:41,664 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:32:42,325 - INFO - Authentication (publickey) successful!
-2024-12-14 15:32:42,342 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:32:42,394 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:32:42,448 - INFO - ===============================================
-2024-12-14 15:32:42,448 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:33:04,241 - INFO - Circuit initialization time: 21.792965 seconds.
-2024-12-14 15:33:04,242 - INFO - Estimating logical resources...
-2024-12-14 15:33:09,380 - INFO - Resource estimation time (seconds): 5.13869
-2024-12-14 15:33:09,381 - INFO - Analyzing task fc25a232-d249-4e1c-a9ec-360cab33f779...
-2024-12-14 15:33:09,381 - INFO - number of supporting files: 1
-2024-12-14 15:33:09,381 - INFO - supporting data file UUID: d9341cde-90e8-4d1e-beb2-4e40246d31ce.
-2024-12-14 15:33:09,381 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz.
-2024-12-14 15:33:09,381 - INFO - assuming FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz is an FCIDUMP file.
-2024-12-14 15:33:09,381 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz...
-2024-12-14 15:33:09,387 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:33:10,051 - INFO - Authentication (publickey) successful!
-2024-12-14 15:33:10,066 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:33:10,138 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:33:10,353 - INFO - ===============================================
-2024-12-14 15:33:10,353 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:34:39,499 - INFO - Circuit initialization time: 89.146106 seconds.
-2024-12-14 15:34:39,499 - INFO - Estimating logical resources...
-2024-12-14 15:34:55,050 - INFO - Resource estimation time (seconds): 15.550888
-2024-12-14 15:34:55,050 - INFO - Analyzing task b99ec02f-b46a-43fe-8a87-1b3286e072d8...
-2024-12-14 15:34:55,050 - INFO - number of supporting files: 1
-2024-12-14 15:34:55,050 - INFO - supporting data file UUID: 5439a548-153b-4990-be12-f0e33c30fe63.
-2024-12-14 15:34:55,051 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz.
-2024-12-14 15:34:55,051 - INFO - assuming FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz is an FCIDUMP file.
-2024-12-14 15:34:55,051 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz...
-2024-12-14 15:34:55,056 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:34:55,728 - INFO - Authentication (publickey) successful!
-2024-12-14 15:34:55,746 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:34:58,521 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:35:08,089 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 15:35:08,090 - INFO - Analyzing task 8874bf11-f594-41df-b8a0-d2a7441904a1...
-2024-12-14 15:35:08,090 - INFO - number of supporting files: 1
-2024-12-14 15:35:08,090 - INFO - supporting data file UUID: e2995852-9911-4021-a82f-5b14ddb2d5c8.
-2024-12-14 15:35:08,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz.
-2024-12-14 15:35:08,090 - INFO - assuming FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz is an FCIDUMP file.
-2024-12-14 15:35:08,090 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz...
-2024-12-14 15:35:08,096 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:35:08,579 - INFO - Authentication (publickey) successful!
-2024-12-14 15:35:08,593 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:35:16,152 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:35:30,736 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 15:35:30,736 - INFO - Analyzing task 202e6184-1e7d-4c02-a82a-f588b6abf809...
-2024-12-14 15:35:30,736 - INFO - number of supporting files: 1
-2024-12-14 15:35:30,736 - INFO - supporting data file UUID: 67acc90d-1a9e-49a7-98a1-8ca643dca272.
-2024-12-14 15:35:30,736 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz.
-2024-12-14 15:35:30,736 - INFO - assuming FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz is an FCIDUMP file.
-2024-12-14 15:35:30,736 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz...
-2024-12-14 15:35:30,741 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:35:31,403 - INFO - Authentication (publickey) successful!
-2024-12-14 15:35:31,427 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:35:31,710 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:35:31,762 - INFO - ===============================================
-2024-12-14 15:35:31,762 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:35:51,918 - INFO - Circuit initialization time: 20.156168 seconds.
-2024-12-14 15:35:51,918 - INFO - Estimating logical resources...
-2024-12-14 15:35:57,084 - INFO - Resource estimation time (seconds): 5.166171
-2024-12-14 15:35:57,085 - INFO - Analyzing task 7c8f0a36-cda5-4b33-bb46-4e58a15b37a1...
-2024-12-14 15:35:57,085 - INFO - number of supporting files: 1
-2024-12-14 15:35:57,085 - INFO - supporting data file UUID: 01d526fb-276e-4369-85d4-66a553a1d02e.
-2024-12-14 15:35:57,085 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz.
-2024-12-14 15:35:57,085 - INFO - assuming FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz is an FCIDUMP file.
-2024-12-14 15:35:57,085 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz...
-2024-12-14 15:35:57,090 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:35:57,754 - INFO - Authentication (publickey) successful!
-2024-12-14 15:35:57,768 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:35:57,829 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:35:58,032 - INFO - ===============================================
-2024-12-14 15:35:58,032 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:37:22,831 - INFO - Circuit initialization time: 84.798385 seconds.
-2024-12-14 15:37:22,831 - INFO - Estimating logical resources...
-2024-12-14 15:37:37,307 - INFO - Resource estimation time (seconds): 14.476388
-2024-12-14 15:37:37,308 - INFO - Analyzing task cbab5937-5e2f-4f3f-819e-ede8b66d7238...
-2024-12-14 15:37:37,308 - INFO - number of supporting files: 1
-2024-12-14 15:37:37,308 - INFO - supporting data file UUID: b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.
-2024-12-14 15:37:37,308 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz.
-2024-12-14 15:37:37,308 - INFO - assuming FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz is an FCIDUMP file.
-2024-12-14 15:37:37,308 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz...
-2024-12-14 15:37:37,313 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:37:37,992 - INFO - Authentication (publickey) successful!
-2024-12-14 15:37:38,007 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:37:42,934 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:37:52,316 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 15:37:52,317 - INFO - Analyzing task c28e09e1-5983-42f7-9ecb-b271438ebcc8...
-2024-12-14 15:37:52,317 - INFO - number of supporting files: 1
-2024-12-14 15:37:52,317 - INFO - supporting data file UUID: 2101e6fa-9fb3-4697-98be-25a4e0de2079.
-2024-12-14 15:37:52,317 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz.
-2024-12-14 15:37:52,317 - INFO - assuming FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz is an FCIDUMP file.
-2024-12-14 15:37:52,317 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz...
-2024-12-14 15:37:52,322 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:37:52,996 - INFO - Authentication (publickey) successful!
-2024-12-14 15:37:53,011 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:38:00,514 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:38:14,983 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 15:38:14,986 - INFO - parsing ../problem_instances/problem_instance.be_0.19cada59-64cc-466c-8809-782a4f574dcc.json
-2024-12-14 15:38:14,986 - INFO - problem_instance UUID: 19cada59-64cc-466c-8809-782a4f574dcc
-2024-12-14 15:38:14,986 - INFO - problem_instance short name: be_0
-2024-12-14 15:38:14,986 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:38:15,001 - INFO - Skipping task 3fb92ecd-bcbc-43dd-9f29-aa56ea646b75 because no overlap was provided.
-2024-12-14 15:38:15,002 - INFO - Analyzing task afdc2f74-eb52-41ae-b72a-30e5a4c07013...
-2024-12-14 15:38:15,002 - INFO - number of supporting files: 2
-2024-12-14 15:38:15,002 - INFO - supporting data file UUID: f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.
-2024-12-14 15:38:15,002 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz.
-2024-12-14 15:38:15,002 - INFO - assuming fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz is an FCIDUMP file.
-2024-12-14 15:38:15,002 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz...
-2024-12-14 15:38:15,007 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:38:15,498 - INFO - Authentication (publickey) successful!
-2024-12-14 15:38:15,513 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:38:16,156 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:38:18,998 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 15:38:18,998 - INFO - supporting data file UUID: 26c5cd51-33c9-4c10-969e-07daa488861d.
-2024-12-14 15:38:18,998 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/be_cc-pVQZ.26c5cd51-33c9-4c10-969e-07daa488861d.chk.
-2024-12-14 15:38:18,998 - INFO - assuming be_cc-pVQZ.26c5cd51-33c9-4c10-969e-07daa488861d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:38:18,999 - INFO - Analyzing task 543e2ed4-a12d-495b-a246-1e4d905ad4a3...
-2024-12-14 15:38:18,999 - INFO - number of supporting files: 2
-2024-12-14 15:38:18,999 - INFO - supporting data file UUID: fdc83bd0-c9bd-47da-abee-99b743b36494.
-2024-12-14 15:38:18,999 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz.
-2024-12-14 15:38:18,999 - INFO - assuming fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz is an FCIDUMP file.
-2024-12-14 15:38:18,999 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz...
-2024-12-14 15:38:19,006 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:38:19,670 - INFO - Authentication (publickey) successful!
-2024-12-14 15:38:19,685 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:38:19,781 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:38:20,107 - INFO - ===============================================
-2024-12-14 15:38:20,107 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:40:34,370 - INFO - Circuit initialization time: 134.262801 seconds.
-2024-12-14 15:40:34,371 - INFO - Estimating logical resources...
-2024-12-14 15:40:53,199 - INFO - Resource estimation time (seconds): 18.828209
-2024-12-14 15:40:53,199 - INFO - supporting data file UUID: fedfefb8-56ab-4bf5-8607-fe3950fd5962.
-2024-12-14 15:40:53,199 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/be_cc-pVTZ.fedfefb8-56ab-4bf5-8607-fe3950fd5962.chk.
-2024-12-14 15:40:53,199 - INFO - assuming be_cc-pVTZ.fedfefb8-56ab-4bf5-8607-fe3950fd5962.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:40:53,201 - INFO - parsing ../problem_instances/problem_instance.f2_0.e3e78b41-577d-4536-a63f-7e968eeb6493.json
-2024-12-14 15:40:53,201 - INFO - problem_instance UUID: e3e78b41-577d-4536-a63f-7e968eeb6493
-2024-12-14 15:40:53,202 - INFO - problem_instance short name: f2_0
-2024-12-14 15:40:53,202 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:40:53,217 - INFO - Analyzing task 94fc2317-29af-43a1-aaec-dade9850ca27...
-2024-12-14 15:40:53,217 - INFO - number of supporting files: 2
-2024-12-14 15:40:53,217 - INFO - supporting data file UUID: ac269a87-2bc4-458e-8f4a-64f524c77044.
-2024-12-14 15:40:53,217 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz.
-2024-12-14 15:40:53,217 - INFO - assuming fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz is an FCIDUMP file.
-2024-12-14 15:40:53,217 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz...
-2024-12-14 15:40:53,230 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:40:53,876 - INFO - Authentication (publickey) successful!
-2024-12-14 15:40:53,891 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:40:53,969 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:40:54,249 - INFO - ===============================================
-2024-12-14 15:40:54,249 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:42:16,214 - INFO - Circuit initialization time: 81.964277 seconds.
-2024-12-14 15:42:16,214 - INFO - Estimating logical resources...
-2024-12-14 15:42:32,729 - INFO - Resource estimation time (seconds): 16.514769
-2024-12-14 15:42:32,729 - INFO - supporting data file UUID: 6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.
-2024-12-14 15:42:32,729 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVDZ.6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.chk.
-2024-12-14 15:42:32,729 - INFO - assuming f2_cc-pVDZ.6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:42:32,729 - INFO - Analyzing task fa8e83f2-cec5-4609-9b77-d713608a6b53...
-2024-12-14 15:42:32,729 - INFO - number of supporting files: 2
-2024-12-14 15:42:32,729 - INFO - supporting data file UUID: 29d645f8-ce30-4e18-9f41-644ac5f9d922.
-2024-12-14 15:42:32,729 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz.
-2024-12-14 15:42:32,729 - INFO - assuming fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz is an FCIDUMP file.
-2024-12-14 15:42:32,729 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz...
-2024-12-14 15:42:32,735 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:42:33,393 - INFO - Authentication (publickey) successful!
-2024-12-14 15:42:33,407 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:44:32,182 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:45:30,967 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 15:45:30,967 - INFO - supporting data file UUID: 5c169867-7d8c-44d8-8b34-4ecc34cd9649.
-2024-12-14 15:45:30,967 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVQZ.5c169867-7d8c-44d8-8b34-4ecc34cd9649.chk.
-2024-12-14 15:45:30,967 - INFO - assuming f2_cc-pVQZ.5c169867-7d8c-44d8-8b34-4ecc34cd9649.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:45:30,968 - INFO - Analyzing task 3fb371ad-c738-40ae-b9ae-80e5bce8f2ac...
-2024-12-14 15:45:30,968 - INFO - number of supporting files: 2
-2024-12-14 15:45:30,968 - INFO - supporting data file UUID: 3c3967d4-17c1-4947-9465-b9223b01e694.
-2024-12-14 15:45:30,968 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz.
-2024-12-14 15:45:30,968 - INFO - assuming fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz is an FCIDUMP file.
-2024-12-14 15:45:30,968 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz...
-2024-12-14 15:45:30,973 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:45:31,635 - INFO - Authentication (publickey) successful!
-2024-12-14 15:45:31,648 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:45:32,748 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:45:37,838 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 15:45:37,839 - INFO - supporting data file UUID: 8627efa5-5412-4e91-9cd0-2a582c3c7c20.
-2024-12-14 15:45:37,839 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVTZ.8627efa5-5412-4e91-9cd0-2a582c3c7c20.chk.
-2024-12-14 15:45:37,839 - INFO - assuming f2_cc-pVTZ.8627efa5-5412-4e91-9cd0-2a582c3c7c20.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:45:37,843 - INFO - parsing ../problem_instances/problem_instance.n2_0.9bd9cde6-6daa-441a-984e-ae1c1c051e91.json
-2024-12-14 15:45:37,843 - INFO - problem_instance UUID: 9bd9cde6-6daa-441a-984e-ae1c1c051e91
-2024-12-14 15:45:37,843 - INFO - problem_instance short name: n2_0
-2024-12-14 15:45:37,843 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:45:37,865 - INFO - Analyzing task b9c35349-927d-47d5-8e0c-e054bbf4e4e0...
-2024-12-14 15:45:37,865 - INFO - number of supporting files: 2
-2024-12-14 15:45:37,865 - INFO - supporting data file UUID: 60c52c22-d27a-4544-8b9c-6022507611f9.
-2024-12-14 15:45:37,865 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz.
-2024-12-14 15:45:37,865 - INFO - assuming fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz is an FCIDUMP file.
-2024-12-14 15:45:37,865 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz...
-2024-12-14 15:45:37,872 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:45:38,525 - INFO - Authentication (publickey) successful!
-2024-12-14 15:45:38,539 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:45:38,609 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:45:38,855 - INFO - ===============================================
-2024-12-14 15:45:38,855 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:47:00,082 - INFO - Circuit initialization time: 81.226787 seconds.
-2024-12-14 15:47:00,083 - INFO - Estimating logical resources...
-2024-12-14 15:47:17,749 - INFO - Resource estimation time (seconds): 17.6651
-2024-12-14 15:47:17,749 - INFO - supporting data file UUID: a107e4ce-0b43-437a-8c59-c2c249d1798d.
-2024-12-14 15:47:17,749 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVDZ.a107e4ce-0b43-437a-8c59-c2c249d1798d.chk.
-2024-12-14 15:47:17,749 - INFO - assuming n2_cc-pVDZ.a107e4ce-0b43-437a-8c59-c2c249d1798d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:47:17,749 - INFO - Analyzing task 9eed79e4-b195-4474-b280-fe9166a7a241...
-2024-12-14 15:47:17,749 - INFO - number of supporting files: 2
-2024-12-14 15:47:17,749 - INFO - supporting data file UUID: e84ef191-bfe0-4859-96b9-0613cad743d4.
-2024-12-14 15:47:17,749 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz.
-2024-12-14 15:47:17,749 - INFO - assuming fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz is an FCIDUMP file.
-2024-12-14 15:47:17,749 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz...
-2024-12-14 15:47:17,755 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:47:18,390 - INFO - Authentication (publickey) successful!
-2024-12-14 15:47:18,405 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:49:01,905 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:49:57,732 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 15:49:57,733 - INFO - supporting data file UUID: bb706eb0-f001-4938-8b70-b9f742942f45.
-2024-12-14 15:49:57,733 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVQZ.bb706eb0-f001-4938-8b70-b9f742942f45.chk.
-2024-12-14 15:49:57,733 - INFO - assuming n2_cc-pVQZ.bb706eb0-f001-4938-8b70-b9f742942f45.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:49:57,733 - INFO - Analyzing task 666185aa-b65d-4f73-8846-ae9693388d9d...
-2024-12-14 15:49:57,733 - INFO - number of supporting files: 2
-2024-12-14 15:49:57,733 - INFO - supporting data file UUID: 48512c28-04a3-4e3b-b6b2-3e4b654c1887.
-2024-12-14 15:49:57,733 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz.
-2024-12-14 15:49:57,733 - INFO - assuming fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz is an FCIDUMP file.
-2024-12-14 15:49:57,733 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz...
-2024-12-14 15:49:57,742 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:49:58,378 - INFO - Authentication (publickey) successful!
-2024-12-14 15:49:58,392 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:49:59,280 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:04,098 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 15:50:04,098 - INFO - supporting data file UUID: 5235f91b-19a0-4122-b54f-99051ccf0480.
-2024-12-14 15:50:04,098 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVTZ.5235f91b-19a0-4122-b54f-99051ccf0480.chk.
-2024-12-14 15:50:04,098 - INFO - assuming n2_cc-pVTZ.5235f91b-19a0-4122-b54f-99051ccf0480.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:50:04,100 - INFO - parsing ../problem_instances/problem_instance.fe_red.a8895776-3583-4884-fbc7-d6f9df21a7ac.json
-2024-12-14 15:50:04,101 - INFO - problem_instance UUID: a8895776-3583-4884-fbc7-d6f9df21a7ac
-2024-12-14 15:50:04,101 - INFO - problem_instance short name: fe_red
-2024-12-14 15:50:04,101 - INFO - contains 9 associated Hamiltonians.
-2024-12-14 15:50:04,116 - INFO - Analyzing task 4970c526-817f-4c04-8d7e-797526d5948d...
-2024-12-14 15:50:04,116 - INFO - number of supporting files: 1
-2024-12-14 15:50:04,116 - INFO - supporting data file UUID: 79e71b3e-6364-4972-b4b3-07841fa8ba97.
-2024-12-14 15:50:04,116 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz.
-2024-12-14 15:50:04,117 - INFO - assuming fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz is an FCIDUMP file.
-2024-12-14 15:50:04,117 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz...
-2024-12-14 15:50:04,122 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:04,780 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:04,800 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:05,046 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:06,846 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 15:50:06,846 - INFO - Analyzing task d27fb590-4e90-4d5a-bdb8-37fbf22f528b...
-2024-12-14 15:50:06,846 - INFO - number of supporting files: 1
-2024-12-14 15:50:06,846 - INFO - supporting data file UUID: e8f72c80-2fde-4bdc-ac1e-07220942f1c2.
-2024-12-14 15:50:06,846 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz.
-2024-12-14 15:50:06,846 - INFO - assuming fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz is an FCIDUMP file.
-2024-12-14 15:50:06,846 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz...
-2024-12-14 15:50:06,851 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:07,536 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:07,553 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:08,059 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:10,533 - INFO - Skipping Logical Resource Estimate because number of orbitals (53) exceeds maximum specified in config (32).
-2024-12-14 15:50:10,533 - INFO - Analyzing task a7cd2501-2f67-4fcd-b428-f6620f3596fe...
-2024-12-14 15:50:10,533 - INFO - number of supporting files: 1
-2024-12-14 15:50:10,533 - INFO - supporting data file UUID: 4854c3ff-b3ce-462b-ab8e-0b132cd880d0.
-2024-12-14 15:50:10,533 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz.
-2024-12-14 15:50:10,533 - INFO - assuming fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz is an FCIDUMP file.
-2024-12-14 15:50:10,533 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz...
-2024-12-14 15:50:10,538 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:11,179 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:11,197 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:12,105 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:17,000 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 15:50:17,000 - INFO - Analyzing task d3bcc63c-57ad-4346-8290-e36447186440...
-2024-12-14 15:50:17,000 - INFO - number of supporting files: 1
-2024-12-14 15:50:17,000 - INFO - supporting data file UUID: 379a0693-4ac3-4ff0-be33-7be3f6cad84f.
-2024-12-14 15:50:17,000 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz.
-2024-12-14 15:50:17,000 - INFO - assuming fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz is an FCIDUMP file.
-2024-12-14 15:50:17,000 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz...
-2024-12-14 15:50:17,006 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:17,682 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:17,697 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:17,980 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:19,623 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 15:50:19,623 - INFO - Analyzing task 41907f9f-923d-49e3-80a9-519962110ae7...
-2024-12-14 15:50:19,623 - INFO - number of supporting files: 1
-2024-12-14 15:50:19,623 - INFO - supporting data file UUID: 22ab7092-61bb-401f-ac43-912ec10ea48b.
-2024-12-14 15:50:19,623 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz.
-2024-12-14 15:50:19,623 - INFO - assuming fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz is an FCIDUMP file.
-2024-12-14 15:50:19,624 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz...
-2024-12-14 15:50:19,628 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:20,303 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:20,317 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:20,986 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:24,727 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:50:24,727 - INFO - Analyzing task ad9ceeaf-d7be-46b7-95a9-15bfd33f5022...
-2024-12-14 15:50:24,727 - INFO - number of supporting files: 1
-2024-12-14 15:50:24,727 - INFO - supporting data file UUID: 8a8780b0-a0ba-4b7e-9847-589302123e86.
-2024-12-14 15:50:24,727 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz.
-2024-12-14 15:50:24,728 - INFO - assuming fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz is an FCIDUMP file.
-2024-12-14 15:50:24,728 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz...
-2024-12-14 15:50:24,738 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:25,399 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:25,412 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:26,060 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:30,107 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 15:50:30,107 - INFO - Analyzing task adecdd92-73c7-416d-90da-b7a3da7ed50b...
-2024-12-14 15:50:30,107 - INFO - number of supporting files: 1
-2024-12-14 15:50:30,107 - INFO - supporting data file UUID: e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.
-2024-12-14 15:50:30,107 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz.
-2024-12-14 15:50:30,107 - INFO - assuming fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz is an FCIDUMP file.
-2024-12-14 15:50:30,107 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz...
-2024-12-14 15:50:30,112 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:30,757 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:30,778 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:30,970 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:32,581 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 15:50:32,581 - INFO - Analyzing task 03c70feb-49b8-4113-831a-05e3ae55c66b...
-2024-12-14 15:50:32,581 - INFO - number of supporting files: 1
-2024-12-14 15:50:32,581 - INFO - supporting data file UUID: eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.
-2024-12-14 15:50:32,581 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz.
-2024-12-14 15:50:32,582 - INFO - assuming fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz is an FCIDUMP file.
-2024-12-14 15:50:32,582 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz...
-2024-12-14 15:50:32,586 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:33,251 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:33,267 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:33,908 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:37,618 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:50:37,618 - INFO - Analyzing task 0e936335-6370-4587-92f0-02eafaf650ed...
-2024-12-14 15:50:37,619 - INFO - number of supporting files: 1
-2024-12-14 15:50:37,619 - INFO - supporting data file UUID: 5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.
-2024-12-14 15:50:37,619 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz.
-2024-12-14 15:50:37,619 - INFO - assuming fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz is an FCIDUMP file.
-2024-12-14 15:50:37,619 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz...
-2024-12-14 15:50:37,624 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:38,289 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:38,305 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:39,339 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:43,290 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 15:50:43,292 - INFO - parsing ../problem_instances/problem_instance.Fe_1.33c9a058-7a67-454c-856c-2519ba55b44d.json
-2024-12-14 15:50:43,292 - INFO - problem_instance UUID: 33c9a058-7a67-454c-856c-2519ba55b44d
-2024-12-14 15:50:43,292 - INFO - problem_instance short name: Fe_1
-2024-12-14 15:50:43,292 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:50:43,307 - INFO - Analyzing task a7e26b10-bd6b-457c-978e-9050f6529007...
-2024-12-14 15:50:43,308 - INFO - number of supporting files: 2
-2024-12-14 15:50:43,308 - INFO - supporting data file UUID: b57e3b82-2511-4c00-a850-f6aeba98b0b2.
-2024-12-14 15:50:43,308 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz.
-2024-12-14 15:50:43,308 - INFO - assuming fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz is an FCIDUMP file.
-2024-12-14 15:50:43,308 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz...
-2024-12-14 15:50:43,312 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:43,949 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:43,966 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:44,735 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:48,465 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:50:48,465 - INFO - supporting data file UUID: eaab709a-c628-4295-85d0-412071d1d7cc.
-2024-12-14 15:50:48,465 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe1_vdz.eaab709a-c628-4295-85d0-412071d1d7cc.chk.
-2024-12-14 15:50:48,466 - INFO - assuming Fe1_vdz.eaab709a-c628-4295-85d0-412071d1d7cc.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:50:48,466 - INFO - Analyzing task 6ab8d16c-b8f3-4780-b278-dad81646ca8c...
-2024-12-14 15:50:48,466 - INFO - number of supporting files: 2
-2024-12-14 15:50:48,466 - INFO - supporting data file UUID: b9615d62-11ee-49f7-8df4-df94466b2211.
-2024-12-14 15:50:48,466 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz.
-2024-12-14 15:50:48,466 - INFO - assuming fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz is an FCIDUMP file.
-2024-12-14 15:50:48,466 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz...
-2024-12-14 15:50:48,471 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:49,106 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:49,121 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:59,333 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:51:15,516 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 15:51:15,516 - INFO - supporting data file UUID: 7421b0eb-3b7f-42d6-ae6b-6583666b38e2.
-2024-12-14 15:51:15,516 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe1_vtz.7421b0eb-3b7f-42d6-ae6b-6583666b38e2.chk.
-2024-12-14 15:51:15,516 - INFO - assuming Fe1_vtz.7421b0eb-3b7f-42d6-ae6b-6583666b38e2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:51:15,523 - INFO - parsing ../problem_instances/problem_instance.ScO_0.7437abf0-1394-47ce-9218-d181f1732112.json
-2024-12-14 15:51:15,523 - INFO - problem_instance UUID: 7437abf0-1394-47ce-9218-d181f1732112
-2024-12-14 15:51:15,523 - INFO - problem_instance short name: ScO_0
-2024-12-14 15:51:15,523 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:51:15,538 - INFO - Analyzing task 9fa4fc3a-b0b9-4eaa-99ee-0469ae5a511d...
-2024-12-14 15:51:15,539 - INFO - number of supporting files: 2
-2024-12-14 15:51:15,539 - INFO - supporting data file UUID: 987498ce-5b91-4df6-924c-82d4841c17c2.
-2024-12-14 15:51:15,539 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz.
-2024-12-14 15:51:15,539 - INFO - assuming fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz is an FCIDUMP file.
-2024-12-14 15:51:15,539 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz...
-2024-12-14 15:51:15,553 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:51:16,125 - INFO - Authentication (publickey) successful!
-2024-12-14 15:51:16,142 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:51:21,569 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:51:33,715 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 15:51:33,715 - INFO - supporting data file UUID: 249d53eb-a925-4b2b-92eb-5a7b05c39069.
-2024-12-14 15:51:33,715 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/ScO_vdz.249d53eb-a925-4b2b-92eb-5a7b05c39069.chk.
-2024-12-14 15:51:33,715 - INFO - assuming ScO_vdz.249d53eb-a925-4b2b-92eb-5a7b05c39069.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:51:33,717 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0003.a37c86c0-1937-4f05-83ab-08a5fd104b7e.json
-2024-12-14 15:51:33,717 - INFO - problem_instance UUID: a37c86c0-1937-4f05-83ab-08a5fd104b7e
-2024-12-14 15:51:33,717 - INFO - problem_instance short name: planted_solution_0003
-2024-12-14 15:51:33,717 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:51:33,732 - INFO - Analyzing task 472bbfb1-c081-4df6-b966-32ce1194ab8c...
-2024-12-14 15:51:33,732 - INFO - number of supporting files: 1
-2024-12-14 15:51:33,732 - INFO - supporting data file UUID: efddd28a-383d-4929-9335-22e54ba2ffbe.
-2024-12-14 15:51:33,732 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz.
-2024-12-14 15:51:33,733 - INFO - assuming fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz is an FCIDUMP file.
-2024-12-14 15:51:33,733 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz...
-2024-12-14 15:51:33,737 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:51:34,238 - INFO - Authentication (publickey) successful!
-2024-12-14 15:51:34,251 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:51:34,336 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:51:34,702 - INFO - ===============================================
-2024-12-14 15:51:34,702 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 15:54:54,866 - INFO - Circuit initialization time: 200.164215 seconds.
-2024-12-14 15:54:54,867 - INFO - Estimating logical resources...
-2024-12-14 15:55:01,660 - INFO - Resource estimation time (seconds): 6.793141
-2024-12-14 15:55:01,662 - INFO - parsing ../problem_instances/problem_instance.h_c_n_0.8846a90e-96cb-4bc3-ad06-5388212f728e.json
-2024-12-14 15:55:01,662 - INFO - problem_instance UUID: 8846a90e-96cb-4bc3-ad06-5388212f728e
-2024-12-14 15:55:01,662 - INFO - problem_instance short name: h_c_n_0
-2024-12-14 15:55:01,662 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:55:01,678 - INFO - Analyzing task 94db0c2c-89f6-4c3d-b886-a3a6a2bdad1d...
-2024-12-14 15:55:01,678 - INFO - number of supporting files: 2
-2024-12-14 15:55:01,678 - INFO - supporting data file UUID: 8ab023ed-7cdf-49e6-87d9-369a13f2ac82.
-2024-12-14 15:55:01,678 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz.
-2024-12-14 15:55:01,678 - INFO - assuming fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz is an FCIDUMP file.
-2024-12-14 15:55:01,678 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz...
-2024-12-14 15:55:01,777 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:55:02,414 - INFO - Authentication (publickey) successful!
-2024-12-14 15:55:02,429 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:55:02,703 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:55:03,226 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 15:55:03,227 - INFO - supporting data file UUID: 46053168-a236-4e18-a305-965bdce3e019.
-2024-12-14 15:55:03,227 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_c_n_cc-pVDZ.46053168-a236-4e18-a305-965bdce3e019.chk.
-2024-12-14 15:55:03,227 - INFO - assuming h_c_n_cc-pVDZ.46053168-a236-4e18-a305-965bdce3e019.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:55:03,227 - INFO - Analyzing task c5ef4702-fc8d-4168-b594-8d5872fdb523...
-2024-12-14 15:55:03,227 - INFO - number of supporting files: 2
-2024-12-14 15:55:03,227 - INFO - supporting data file UUID: 6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.
-2024-12-14 15:55:03,227 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz.
-2024-12-14 15:55:03,227 - INFO - assuming fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz is an FCIDUMP file.
-2024-12-14 15:55:03,227 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz...
-2024-12-14 15:55:03,232 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:55:03,904 - INFO - Authentication (publickey) successful!
-2024-12-14 15:55:03,925 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:55:08,230 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:55:19,200 - INFO - Skipping Logical Resource Estimate because number of orbitals (74) exceeds maximum specified in config (32).
-2024-12-14 15:55:19,201 - INFO - supporting data file UUID: 6e127086-f92c-4ff5-ab61-7999670be0e7.
-2024-12-14 15:55:19,201 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_c_n_cc-pVTZ.6e127086-f92c-4ff5-ab61-7999670be0e7.chk.
-2024-12-14 15:55:19,201 - INFO - assuming h_c_n_cc-pVTZ.6e127086-f92c-4ff5-ab61-7999670be0e7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:55:19,202 - INFO - parsing ../problem_instances/problem_instance.si_h4_0.13c7144d-047e-4431-8d02-0b1d14c0526b.json
-2024-12-14 15:55:19,203 - INFO - problem_instance UUID: 13c7144d-047e-4431-8d02-0b1d14c0526b
-2024-12-14 15:55:19,203 - INFO - problem_instance short name: si_h4_0
-2024-12-14 15:55:19,203 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:55:19,224 - INFO - Analyzing task 2eaee11d-c1a0-4d2b-b29b-a38e658572f2...
-2024-12-14 15:55:19,225 - INFO - number of supporting files: 2
-2024-12-14 15:55:19,225 - INFO - supporting data file UUID: c37edb04-5163-4d5c-a54e-df5887f0d82e.
-2024-12-14 15:55:19,225 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz.
-2024-12-14 15:55:19,225 - INFO - assuming fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz is an FCIDUMP file.
-2024-12-14 15:55:19,225 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz...
-2024-12-14 15:55:19,232 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:55:19,872 - INFO - Authentication (publickey) successful!
-2024-12-14 15:55:19,889 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:55:20,092 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:55:21,795 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 15:55:21,795 - INFO - supporting data file UUID: de9aba1e-5c4d-4372-8895-d1495c7af8fa.
-2024-12-14 15:55:21,795 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h4_cc-pVDZ.de9aba1e-5c4d-4372-8895-d1495c7af8fa.chk.
-2024-12-14 15:55:21,795 - INFO - assuming si_h4_cc-pVDZ.de9aba1e-5c4d-4372-8895-d1495c7af8fa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:55:21,795 - INFO - Analyzing task 6ca72d49-425b-43f3-96e7-4067bacd0596...
-2024-12-14 15:55:21,795 - INFO - number of supporting files: 2
-2024-12-14 15:55:21,795 - INFO - supporting data file UUID: e709c0b6-d851-47d2-b72a-f4da8479a772.
-2024-12-14 15:55:21,795 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz.
-2024-12-14 15:55:21,796 - INFO - assuming fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz is an FCIDUMP file.
-2024-12-14 15:55:21,796 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz...
-2024-12-14 15:55:21,801 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:55:22,455 - INFO - Authentication (publickey) successful!
-2024-12-14 15:55:22,478 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:57:00,271 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:57:53,165 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 15:57:53,165 - INFO - supporting data file UUID: 10435f0a-a736-4c87-957b-f7a1183b2eca.
-2024-12-14 15:57:53,165 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h4_cc-pVTZ.10435f0a-a736-4c87-957b-f7a1183b2eca.chk.
-2024-12-14 15:57:53,165 - INFO - assuming si_h4_cc-pVTZ.10435f0a-a736-4c87-957b-f7a1183b2eca.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:57:53,167 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0009.8db449b1-265b-4a66-b965-a2b4833a88d1.json
-2024-12-14 15:57:53,167 - INFO - problem_instance UUID: 8db449b1-265b-4a66-b965-a2b4833a88d1
-2024-12-14 15:57:53,167 - INFO - problem_instance short name: planted_solution_0009
-2024-12-14 15:57:53,167 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:57:53,183 - INFO - Analyzing task 8f373cb0-952d-48c6-a871-8a10e52e7c19...
-2024-12-14 15:57:53,183 - INFO - number of supporting files: 1
-2024-12-14 15:57:53,183 - INFO - supporting data file UUID: bbbbba1c-868c-45a5-b16c-0c17536e83d8.
-2024-12-14 15:57:53,183 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz.
-2024-12-14 15:57:53,183 - INFO - assuming fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz is an FCIDUMP file.
-2024-12-14 15:57:53,183 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz...
-2024-12-14 15:57:53,188 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:57:53,723 - INFO - Authentication (publickey) successful!
-2024-12-14 15:57:53,740 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:57:56,567 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:58:05,281 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 15:58:05,283 - INFO - parsing ../problem_instances/problem_instance.Mn_1.11c8be98-d9c9-40ea-8d88-ea8c555028f6.json
-2024-12-14 15:58:05,283 - INFO - problem_instance UUID: 11c8be98-d9c9-40ea-8d88-ea8c555028f6
-2024-12-14 15:58:05,283 - INFO - problem_instance short name: Mn_1
-2024-12-14 15:58:05,284 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:58:05,299 - INFO - Analyzing task 9d82f7d4-165d-4499-8add-361a770d1d44...
-2024-12-14 15:58:05,299 - INFO - number of supporting files: 2
-2024-12-14 15:58:05,299 - INFO - supporting data file UUID: 51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.
-2024-12-14 15:58:05,299 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz.
-2024-12-14 15:58:05,299 - INFO - assuming fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz is an FCIDUMP file.
-2024-12-14 15:58:05,299 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz...
-2024-12-14 15:58:05,303 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:58:05,945 - INFO - Authentication (publickey) successful!
-2024-12-14 15:58:05,959 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:58:06,663 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:58:09,107 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:58:09,107 - INFO - supporting data file UUID: d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.
-2024-12-14 15:58:09,107 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn1_vdz.d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.chk.
-2024-12-14 15:58:09,107 - INFO - assuming Mn1_vdz.d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:58:09,107 - INFO - Analyzing task 29eecba9-3d4d-4672-8b19-475f53b2f1be...
-2024-12-14 15:58:09,107 - INFO - number of supporting files: 2
-2024-12-14 15:58:09,107 - INFO - supporting data file UUID: 00c757c4-3c99-4521-82b1-3e3a12d49854.
-2024-12-14 15:58:09,107 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz.
-2024-12-14 15:58:09,107 - INFO - assuming fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz is an FCIDUMP file.
-2024-12-14 15:58:09,107 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz...
-2024-12-14 15:58:09,112 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:58:09,730 - INFO - Authentication (publickey) successful!
-2024-12-14 15:58:09,742 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:58:32,968 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:58:59,473 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 15:58:59,473 - INFO - supporting data file UUID: e4481467-4b06-43b0-9e22-b3c5fa930709.
-2024-12-14 15:58:59,473 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn1_vtz.e4481467-4b06-43b0-9e22-b3c5fa930709.chk.
-2024-12-14 15:58:59,473 - INFO - assuming Mn1_vtz.e4481467-4b06-43b0-9e22-b3c5fa930709.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:58:59,474 - INFO - parsing ../problem_instances/problem_instance.c_h3_cl_0.379781b8-5732-492e-9fca-6fad3fc3692a.json
-2024-12-14 15:58:59,475 - INFO - problem_instance UUID: 379781b8-5732-492e-9fca-6fad3fc3692a
-2024-12-14 15:58:59,475 - INFO - problem_instance short name: c_h3_cl_0
-2024-12-14 15:58:59,475 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:58:59,490 - INFO - Analyzing task 0667179a-19eb-44b9-a544-dae8793fdc3f...
-2024-12-14 15:58:59,490 - INFO - number of supporting files: 2
-2024-12-14 15:58:59,490 - INFO - supporting data file UUID: 80298b55-8915-462f-8f20-e4332c94ed41.
-2024-12-14 15:58:59,490 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz.
-2024-12-14 15:58:59,490 - INFO - assuming fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz is an FCIDUMP file.
-2024-12-14 15:58:59,491 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz...
-2024-12-14 15:58:59,495 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:59:00,162 - INFO - Authentication (publickey) successful!
-2024-12-14 15:59:00,180 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:59:00,949 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:59:05,212 - INFO - Skipping Logical Resource Estimate because number of orbitals (47) exceeds maximum specified in config (32).
-2024-12-14 15:59:05,212 - INFO - supporting data file UUID: a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.
-2024-12-14 15:59:05,212 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h3_cl_cc-pVDZ.a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.chk.
-2024-12-14 15:59:05,212 - INFO - assuming c_h3_cl_cc-pVDZ.a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:59:05,212 - INFO - Analyzing task ae315bef-f3c6-4c84-93c5-0d8ab510ece3...
-2024-12-14 15:59:05,212 - INFO - number of supporting files: 2
-2024-12-14 15:59:05,212 - INFO - supporting data file UUID: a53ae008-4ad2-4736-9a57-cfc011e3aace.
-2024-12-14 15:59:05,212 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz.
-2024-12-14 15:59:05,212 - INFO - assuming fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz is an FCIDUMP file.
-2024-12-14 15:59:05,213 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz...
-2024-12-14 15:59:05,217 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:59:05,875 - INFO - Authentication (publickey) successful!
-2024-12-14 15:59:05,891 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:06:08,943 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:07:55,856 - INFO - Skipping Logical Resource Estimate because number of orbitals (106) exceeds maximum specified in config (32).
-2024-12-14 16:07:55,856 - INFO - supporting data file UUID: 17f3e9f1-f59d-4bfd-acbd-f85a3b87cf4a.
-2024-12-14 16:07:55,856 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h3_cl_cc-pVTZ.17f3e9f1-f59d-4bfd-acbd-f85a3b87cf4a.chk.
-2024-12-14 16:07:55,857 - INFO - assuming c_h3_cl_cc-pVTZ.17f3e9f1-f59d-4bfd-acbd-f85a3b87cf4a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:07:55,873 - INFO - parsing ../problem_instances/problem_instance.p2_0.2e61ba35-b6b0-42b5-b3e8-d25bd83145ba.json
-2024-12-14 16:07:55,873 - INFO - problem_instance UUID: 2e61ba35-b6b0-42b5-b3e8-d25bd83145ba
-2024-12-14 16:07:55,873 - INFO - problem_instance short name: p2_0
-2024-12-14 16:07:55,874 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:07:55,889 - INFO - Analyzing task 084acde0-d1c7-4721-aa45-acb4832e0998...
-2024-12-14 16:07:55,889 - INFO - number of supporting files: 2
-2024-12-14 16:07:55,889 - INFO - supporting data file UUID: 7702bafa-2620-4d12-8ec6-e8c6246d385a.
-2024-12-14 16:07:55,889 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a.gz.
-2024-12-14 16:07:55,889 - INFO - assuming fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a.gz is an FCIDUMP file.
-2024-12-14 16:07:55,889 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a.gz...
-2024-12-14 16:07:55,895 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:07:56,548 - INFO - Authentication (publickey) successful!
-2024-12-14 16:07:56,565 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:07:56,701 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:07:57,775 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 16:07:57,776 - INFO - supporting data file UUID: f08ade09-d3e1-469c-8d7f-3a6b8734e06e.
-2024-12-14 16:07:57,776 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p2_cc-pVDZ.f08ade09-d3e1-469c-8d7f-3a6b8734e06e.chk.
-2024-12-14 16:07:57,776 - INFO - assuming p2_cc-pVDZ.f08ade09-d3e1-469c-8d7f-3a6b8734e06e.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:07:57,776 - INFO - Analyzing task e61df0de-0a97-4204-9fb9-3995c30d7999...
-2024-12-14 16:07:57,776 - INFO - number of supporting files: 2
-2024-12-14 16:07:57,776 - INFO - supporting data file UUID: 334dbd9d-2c13-4c76-8479-e82280065a02.
-2024-12-14 16:07:57,776 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02.gz.
-2024-12-14 16:07:57,776 - INFO - assuming fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02.gz is an FCIDUMP file.
-2024-12-14 16:07:57,776 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02.gz...
-2024-12-14 16:07:57,782 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:07:58,452 - INFO - Authentication (publickey) successful!
-2024-12-14 16:07:58,470 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:12:30,853 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:13:57,141 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 16:13:57,142 - INFO - supporting data file UUID: 92f4f69f-4e8d-4059-af53-86516e671585.
-2024-12-14 16:13:57,142 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p2_cc-pVQZ.92f4f69f-4e8d-4059-af53-86516e671585.chk.
-2024-12-14 16:13:57,142 - INFO - assuming p2_cc-pVQZ.92f4f69f-4e8d-4059-af53-86516e671585.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:13:57,143 - INFO - Analyzing task 23a06c81-be81-4f88-98ab-9e7030c909ef...
-2024-12-14 16:13:57,143 - INFO - number of supporting files: 2
-2024-12-14 16:13:57,143 - INFO - supporting data file UUID: 1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.
-2024-12-14 16:13:57,143 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.gz.
-2024-12-14 16:13:57,143 - INFO - assuming fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.gz is an FCIDUMP file.
-2024-12-14 16:13:57,143 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.gz...
-2024-12-14 16:13:57,155 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:13:57,817 - INFO - Authentication (publickey) successful!
-2024-12-14 16:13:57,837 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:14:03,196 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:14:12,786 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 16:14:12,786 - INFO - supporting data file UUID: e7286181-b703-42a7-ad54-2d3a3e741d61.
-2024-12-14 16:14:12,786 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p2_cc-pVTZ.e7286181-b703-42a7-ad54-2d3a3e741d61.chk.
-2024-12-14 16:14:12,786 - INFO - assuming p2_cc-pVTZ.e7286181-b703-42a7-ad54-2d3a3e741d61.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:14:12,788 - INFO - parsing ../problem_instances/problem_instance.si_o_0.68f1a091-8652-4095-ba31-56f0e02e27d3.json
-2024-12-14 16:14:12,788 - INFO - problem_instance UUID: 68f1a091-8652-4095-ba31-56f0e02e27d3
-2024-12-14 16:14:12,788 - INFO - problem_instance short name: si_o_0
-2024-12-14 16:14:12,788 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:14:12,798 - INFO - Analyzing task 88a6b9fd-e159-4059-9ee5-ba718fd624dc...
-2024-12-14 16:14:12,798 - INFO - number of supporting files: 2
-2024-12-14 16:14:12,798 - INFO - supporting data file UUID: ab244b36-ab52-4cce-b50a-2b04d8c548e7.
-2024-12-14 16:14:12,798 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7.gz.
-2024-12-14 16:14:12,798 - INFO - assuming fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7.gz is an FCIDUMP file.
-2024-12-14 16:14:12,799 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7.gz...
-2024-12-14 16:14:12,805 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:14:13,458 - INFO - Authentication (publickey) successful!
-2024-12-14 16:14:13,476 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:14:13,564 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:14:13,974 - INFO - ===============================================
-2024-12-14 16:14:13,975 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 16:17:06,220 - INFO - Circuit initialization time: 172.245378 seconds.
-2024-12-14 16:17:06,220 - INFO - Estimating logical resources...
-2024-12-14 16:17:31,770 - INFO - Resource estimation time (seconds): 25.549363
-2024-12-14 16:17:31,770 - INFO - supporting data file UUID: c2098b79-b369-4b4b-be59-d4e3953debbd.
-2024-12-14 16:17:31,770 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_o_cc-pVDZ.c2098b79-b369-4b4b-be59-d4e3953debbd.chk.
-2024-12-14 16:17:31,770 - INFO - assuming si_o_cc-pVDZ.c2098b79-b369-4b4b-be59-d4e3953debbd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:17:31,770 - INFO - Analyzing task cca08104-f5f6-407f-9c62-faadc8f29bec...
-2024-12-14 16:17:31,770 - INFO - number of supporting files: 2
-2024-12-14 16:17:31,770 - INFO - supporting data file UUID: 80214e7b-2e1f-440f-b9eb-ee9a16ed8398.
-2024-12-14 16:17:31,770 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398.gz.
-2024-12-14 16:17:31,770 - INFO - assuming fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398.gz is an FCIDUMP file.
-2024-12-14 16:17:31,770 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398.gz...
-2024-12-14 16:17:31,775 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:17:32,419 - INFO - Authentication (publickey) successful!
-2024-12-14 16:17:32,433 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:19:31,605 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:20:32,410 - INFO - Skipping Logical Resource Estimate because number of orbitals (114) exceeds maximum specified in config (32).
-2024-12-14 16:20:32,410 - INFO - supporting data file UUID: 5d33c531-597b-4641-9c65-2369f52972b5.
-2024-12-14 16:20:32,410 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_o_cc-pVQZ.5d33c531-597b-4641-9c65-2369f52972b5.chk.
-2024-12-14 16:20:32,410 - INFO - assuming si_o_cc-pVQZ.5d33c531-597b-4641-9c65-2369f52972b5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:20:32,411 - INFO - Analyzing task 8aa559b0-3aae-4850-a2d7-14e037ce26c0...
-2024-12-14 16:20:32,411 - INFO - number of supporting files: 2
-2024-12-14 16:20:32,411 - INFO - supporting data file UUID: 1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.
-2024-12-14 16:20:32,411 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.gz.
-2024-12-14 16:20:32,411 - INFO - assuming fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.gz is an FCIDUMP file.
-2024-12-14 16:20:32,411 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.gz...
-2024-12-14 16:20:32,416 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:20:33,060 - INFO - Authentication (publickey) successful!
-2024-12-14 16:20:33,074 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:20:34,637 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:20:40,746 - INFO - Skipping Logical Resource Estimate because number of orbitals (64) exceeds maximum specified in config (32).
-2024-12-14 16:20:40,746 - INFO - supporting data file UUID: b37630a8-c0e0-4a2f-950f-b132623cf31c.
-2024-12-14 16:20:40,746 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_o_cc-pVTZ.b37630a8-c0e0-4a2f-950f-b132623cf31c.chk.
-2024-12-14 16:20:40,746 - INFO - assuming si_o_cc-pVTZ.b37630a8-c0e0-4a2f-950f-b132623cf31c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:20:40,748 - INFO - parsing ../problem_instances/problem_instance.h2_o_0.9b8083ab-ea59-47db-894c-95a0d2ba3cb6.json
-2024-12-14 16:20:40,749 - INFO - problem_instance UUID: 9b8083ab-ea59-47db-894c-95a0d2ba3cb6
-2024-12-14 16:20:40,749 - INFO - problem_instance short name: h2_o_0
-2024-12-14 16:20:40,749 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:20:40,764 - INFO - Analyzing task 80d75334-b878-41ec-99a8-b21277f3df60...
-2024-12-14 16:20:40,764 - INFO - number of supporting files: 2
-2024-12-14 16:20:40,764 - INFO - supporting data file UUID: 96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.
-2024-12-14 16:20:40,764 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.gz.
-2024-12-14 16:20:40,764 - INFO - assuming fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.gz is an FCIDUMP file.
-2024-12-14 16:20:40,764 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.gz...
-2024-12-14 16:20:40,770 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:20:41,391 - INFO - Authentication (publickey) successful!
-2024-12-14 16:20:41,405 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:20:41,463 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:20:41,571 - INFO - ===============================================
-2024-12-14 16:20:41,571 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 16:21:32,052 - INFO - Circuit initialization time: 50.48078 seconds.
-2024-12-14 16:21:32,052 - INFO - Estimating logical resources...
-2024-12-14 16:21:44,540 - INFO - Resource estimation time (seconds): 12.488183
-2024-12-14 16:21:44,541 - INFO - supporting data file UUID: 3a9877c5-bdd8-42e6-82de-5017afd0758b.
-2024-12-14 16:21:44,541 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o_cc-pVDZ.3a9877c5-bdd8-42e6-82de-5017afd0758b.chk.
-2024-12-14 16:21:44,541 - INFO - assuming h2_o_cc-pVDZ.3a9877c5-bdd8-42e6-82de-5017afd0758b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:21:44,541 - INFO - Analyzing task 5e576716-0df8-4712-8f03-ea1ac3808e35...
-2024-12-14 16:21:44,541 - INFO - number of supporting files: 2
-2024-12-14 16:21:44,541 - INFO - supporting data file UUID: 26e93a92-0fb0-43bf-9c8d-6b97eb974d27.
-2024-12-14 16:21:44,541 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27.gz.
-2024-12-14 16:21:44,541 - INFO - assuming fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27.gz is an FCIDUMP file.
-2024-12-14 16:21:44,541 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27.gz...
-2024-12-14 16:21:44,546 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:21:45,199 - INFO - Authentication (publickey) successful!
-2024-12-14 16:21:45,216 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:23:08,253 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:23:56,930 - INFO - Skipping Logical Resource Estimate because number of orbitals (115) exceeds maximum specified in config (32).
-2024-12-14 16:23:56,930 - INFO - supporting data file UUID: 0480d761-3895-4b3c-9bea-616160b3c807.
-2024-12-14 16:23:56,930 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o_cc-pVQZ.0480d761-3895-4b3c-9bea-616160b3c807.chk.
-2024-12-14 16:23:56,930 - INFO - assuming h2_o_cc-pVQZ.0480d761-3895-4b3c-9bea-616160b3c807.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:23:56,931 - INFO - Analyzing task 4e395cc5-b5d2-4b82-95a2-1276262386c8...
-2024-12-14 16:23:56,931 - INFO - number of supporting files: 2
-2024-12-14 16:23:56,931 - INFO - supporting data file UUID: dd869557-00f9-421f-ab39-faa9d8e05df2.
-2024-12-14 16:23:56,931 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2.gz.
-2024-12-14 16:23:56,931 - INFO - assuming fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2.gz is an FCIDUMP file.
-2024-12-14 16:23:56,931 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2.gz...
-2024-12-14 16:23:56,936 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:23:57,565 - INFO - Authentication (publickey) successful!
-2024-12-14 16:23:57,582 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:23:58,163 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:01,619 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 16:24:01,619 - INFO - supporting data file UUID: 8d8f097e-dd3e-48ed-8cb8-204760a8cfa4.
-2024-12-14 16:24:01,619 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o_cc-pVTZ.8d8f097e-dd3e-48ed-8cb8-204760a8cfa4.chk.
-2024-12-14 16:24:01,619 - INFO - assuming h2_o_cc-pVTZ.8d8f097e-dd3e-48ed-8cb8-204760a8cfa4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:24:01,621 - INFO - parsing ../problem_instances/problem_instance.h_o_cl_0.ea2e13c5-6d80-466e-bd6b-6289e10ed82b.json
-2024-12-14 16:24:01,622 - INFO - problem_instance UUID: ea2e13c5-6d80-466e-bd6b-6289e10ed82b
-2024-12-14 16:24:01,622 - INFO - problem_instance short name: h_o_cl_0
-2024-12-14 16:24:01,622 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:24:01,637 - INFO - Analyzing task bd44e482-057d-42c3-a052-cbd952fa8025...
-2024-12-14 16:24:01,637 - INFO - number of supporting files: 2
-2024-12-14 16:24:01,637 - INFO - supporting data file UUID: 95dec49b-7d4e-4889-9e31-97e21db7b329.
-2024-12-14 16:24:01,637 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329.gz.
-2024-12-14 16:24:01,637 - INFO - assuming fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329.gz is an FCIDUMP file.
-2024-12-14 16:24:01,637 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329.gz...
-2024-12-14 16:24:01,642 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:24:02,302 - INFO - Authentication (publickey) successful!
-2024-12-14 16:24:02,320 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:24:02,554 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:03,833 - INFO - Skipping Logical Resource Estimate because number of orbitals (37) exceeds maximum specified in config (32).
-2024-12-14 16:24:03,833 - INFO - supporting data file UUID: aa593c42-1dff-4302-b3f6-85eb6945f108.
-2024-12-14 16:24:03,833 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_o_cl_cc-pVDZ.aa593c42-1dff-4302-b3f6-85eb6945f108.chk.
-2024-12-14 16:24:03,833 - INFO - assuming h_o_cl_cc-pVDZ.aa593c42-1dff-4302-b3f6-85eb6945f108.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:24:03,833 - INFO - Analyzing task fea4b4a2-64a1-45c3-a760-83aec702bdca...
-2024-12-14 16:24:03,833 - INFO - number of supporting files: 2
-2024-12-14 16:24:03,834 - INFO - supporting data file UUID: e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.
-2024-12-14 16:24:03,834 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.gz.
-2024-12-14 16:24:03,834 - INFO - assuming fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.gz is an FCIDUMP file.
-2024-12-14 16:24:03,834 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.gz...
-2024-12-14 16:24:03,838 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:24:04,566 - INFO - Authentication (publickey) successful!
-2024-12-14 16:24:04,584 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:24:17,736 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:36,636 - INFO - Skipping Logical Resource Estimate because number of orbitals (78) exceeds maximum specified in config (32).
-2024-12-14 16:24:36,636 - INFO - supporting data file UUID: 3f652fb4-0324-46c1-ae9a-d69ed4da1756.
-2024-12-14 16:24:36,636 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_o_cl_cc-pVTZ.3f652fb4-0324-46c1-ae9a-d69ed4da1756.chk.
-2024-12-14 16:24:36,636 - INFO - assuming h_o_cl_cc-pVTZ.3f652fb4-0324-46c1-ae9a-d69ed4da1756.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:24:36,638 - INFO - parsing ../problem_instances/problem_instance.c2_h6_0.b1c5ac4e-9b94-4e89-9557-da2026933172.json
-2024-12-14 16:24:36,638 - INFO - problem_instance UUID: b1c5ac4e-9b94-4e89-9557-da2026933172
-2024-12-14 16:24:36,638 - INFO - problem_instance short name: c2_h6_0
-2024-12-14 16:24:36,638 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:24:36,654 - INFO - Analyzing task 15a25e30-cba9-4f63-80a6-ef95a8c79d41...
-2024-12-14 16:24:36,654 - INFO - number of supporting files: 2
-2024-12-14 16:24:36,654 - INFO - supporting data file UUID: da21513f-c490-45e2-8ce9-1c7a511ca925.
-2024-12-14 16:24:36,654 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925.gz.
-2024-12-14 16:24:36,654 - INFO - assuming fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925.gz is an FCIDUMP file.
-2024-12-14 16:24:36,654 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925.gz...
-2024-12-14 16:24:36,659 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:24:37,170 - INFO - Authentication (publickey) successful!
-2024-12-14 16:24:37,183 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:24:40,480 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:47,686 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 16:24:47,686 - INFO - supporting data file UUID: 3f2b2cd3-e675-403f-bea0-92e5f2a909aa.
-2024-12-14 16:24:47,686 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h6_cc-pVDZ.3f2b2cd3-e675-403f-bea0-92e5f2a909aa.chk.
-2024-12-14 16:24:47,686 - INFO - assuming c2_h6_cc-pVDZ.3f2b2cd3-e675-403f-bea0-92e5f2a909aa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:24:47,688 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0001.3d3b9e8a-7842-4ca1-bd82-eddb9804972d.json
-2024-12-14 16:24:47,722 - INFO - problem_instance UUID: 3d3b9e8a-7842-4ca1-bd82-eddb9804972d
-2024-12-14 16:24:47,722 - INFO - problem_instance short name: planted_solution_0001
-2024-12-14 16:24:47,722 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:24:47,738 - INFO - Analyzing task be3812d3-5975-4736-8a23-96d64e50e66a...
-2024-12-14 16:24:47,738 - INFO - number of supporting files: 1
-2024-12-14 16:24:47,738 - INFO - supporting data file UUID: 3add17d8-cb86-4ae5-8474-96d272269d80.
-2024-12-14 16:24:47,738 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80.gz.
-2024-12-14 16:24:47,738 - INFO - assuming fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80.gz is an FCIDUMP file.
-2024-12-14 16:24:47,738 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80.gz...
-2024-12-14 16:24:47,743 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:24:48,391 - INFO - Authentication (publickey) successful!
-2024-12-14 16:24:48,408 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:24:48,473 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:48,491 - INFO - ===============================================
-2024-12-14 16:24:48,491 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 16:24:57,909 - INFO - Circuit initialization time: 9.417916 seconds.
-2024-12-14 16:24:57,909 - INFO - Estimating logical resources...
-2024-12-14 16:24:59,435 - INFO - Resource estimation time (seconds): 1.525978
-2024-12-14 16:24:59,437 - INFO - parsing ../problem_instances/problem_instance.c_h4_0.e0f6ed02-6502-454b-bf2c-e7994e0510f4.json
-2024-12-14 16:24:59,437 - INFO - problem_instance UUID: e0f6ed02-6502-454b-bf2c-e7994e0510f4
-2024-12-14 16:24:59,437 - INFO - problem_instance short name: c_h4_0
-2024-12-14 16:24:59,437 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:24:59,453 - INFO - Analyzing task 443371ce-c80d-450d-b281-ac1c4d5ecc4d...
-2024-12-14 16:24:59,453 - INFO - number of supporting files: 2
-2024-12-14 16:24:59,453 - INFO - supporting data file UUID: a7321b5d-4730-4ace-9ff8-734ec07f3fef.
-2024-12-14 16:24:59,453 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef.gz.
-2024-12-14 16:24:59,453 - INFO - assuming fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef.gz is an FCIDUMP file.
-2024-12-14 16:24:59,453 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef.gz...
-2024-12-14 16:24:59,458 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:25:00,109 - INFO - Authentication (publickey) successful!
-2024-12-14 16:25:00,127 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:25:00,325 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:25:01,405 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 16:25:01,405 - INFO - supporting data file UUID: 02b1e2b3-66f7-4004-9f27-94d407ab51e1.
-2024-12-14 16:25:01,405 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h4_cc-pVDZ.02b1e2b3-66f7-4004-9f27-94d407ab51e1.chk.
-2024-12-14 16:25:01,405 - INFO - assuming c_h4_cc-pVDZ.02b1e2b3-66f7-4004-9f27-94d407ab51e1.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:25:01,405 - INFO - Analyzing task f936469c-1d1e-4295-a006-84a778c1714c...
-2024-12-14 16:25:01,406 - INFO - number of supporting files: 2
-2024-12-14 16:25:01,406 - INFO - supporting data file UUID: 47a5eadf-e31e-4c38-983f-8c75460463ea.
-2024-12-14 16:25:01,406 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea.gz.
-2024-12-14 16:25:01,406 - INFO - assuming fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea.gz is an FCIDUMP file.
-2024-12-14 16:25:01,406 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea.gz...
-2024-12-14 16:25:01,411 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:25:02,074 - INFO - Authentication (publickey) successful!
-2024-12-14 16:25:02,091 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:26:08,429 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:26:51,026 - INFO - Skipping Logical Resource Estimate because number of orbitals (86) exceeds maximum specified in config (32).
-2024-12-14 16:26:51,026 - INFO - supporting data file UUID: 6e2fb98f-f4d8-47c9-a4f4-496999541f0d.
-2024-12-14 16:26:51,026 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h4_cc-pVTZ.6e2fb98f-f4d8-47c9-a4f4-496999541f0d.chk.
-2024-12-14 16:26:51,026 - INFO - assuming c_h4_cc-pVTZ.6e2fb98f-f4d8-47c9-a4f4-496999541f0d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:26:51,038 - INFO - parsing ../problem_instances/problem_instance.V_1.18e1973e-d6cf-48d6-9ca4-c1af21ff7c98.json
-2024-12-14 16:26:51,038 - INFO - problem_instance UUID: 18e1973e-d6cf-48d6-9ca4-c1af21ff7c98
-2024-12-14 16:26:51,038 - INFO - problem_instance short name: V_1
-2024-12-14 16:26:51,038 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:26:51,055 - INFO - Analyzing task 6d0f8edd-507f-43d5-9960-9ad49532ee42...
-2024-12-14 16:26:51,055 - INFO - number of supporting files: 2
-2024-12-14 16:26:51,055 - INFO - supporting data file UUID: cf7aa422-2b82-4d7c-a031-8923e1fc8a41.
-2024-12-14 16:26:51,055 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41.gz.
-2024-12-14 16:26:51,055 - INFO - assuming fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41.gz is an FCIDUMP file.
-2024-12-14 16:26:51,055 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41.gz...
-2024-12-14 16:26:51,059 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:26:51,710 - INFO - Authentication (publickey) successful!
-2024-12-14 16:26:51,726 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:26:52,322 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:26:55,723 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 16:26:55,724 - INFO - supporting data file UUID: 722f4d71-266b-4bb3-b4fb-d8f9c54ad9d9.
-2024-12-14 16:26:55,724 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V1_vdz.722f4d71-266b-4bb3-b4fb-d8f9c54ad9d9.chk.
-2024-12-14 16:26:55,724 - INFO - assuming V1_vdz.722f4d71-266b-4bb3-b4fb-d8f9c54ad9d9.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:26:55,724 - INFO - Skipping task 106deaf8-422f-4e06-bf25-6191abd6eecf because no overlap was provided.
-2024-12-14 16:26:55,725 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0007.3aaf0bb4-b412-4746-922a-c380b4024d00.json
-2024-12-14 16:26:55,727 - INFO - problem_instance UUID: 3aaf0bb4-b412-4746-922a-c380b4024d00
-2024-12-14 16:26:55,727 - INFO - problem_instance short name: planted_solution_0007
-2024-12-14 16:26:55,727 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:26:55,742 - INFO - Analyzing task d3c058ec-9b13-4a9a-aba0-d3f19091c47b...
-2024-12-14 16:26:55,742 - INFO - number of supporting files: 1
-2024-12-14 16:26:55,742 - INFO - supporting data file UUID: c594d63e-29c7-462a-b385-f70c6d7d8350.
-2024-12-14 16:26:55,742 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350.gz.
-2024-12-14 16:26:55,742 - INFO - assuming fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350.gz is an FCIDUMP file.
-2024-12-14 16:26:55,742 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350.gz...
-2024-12-14 16:26:55,749 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:26:56,390 - INFO - Authentication (publickey) successful!
-2024-12-14 16:26:56,408 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:26:56,495 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:26:56,854 - INFO - ===============================================
-2024-12-14 16:26:56,854 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 16:30:14,565 - INFO - Circuit initialization time: 197.711069 seconds.
-2024-12-14 16:30:14,565 - INFO - Estimating logical resources...
-2024-12-14 16:30:20,795 - INFO - Resource estimation time (seconds): 6.229755
-2024-12-14 16:30:20,797 - INFO - parsing ../problem_instances/problem_instance.Ti_0.c1e4c7dd-2dc4-4dd0-889d-fb34f602965a.json
-2024-12-14 16:30:20,797 - INFO - problem_instance UUID: c1e4c7dd-2dc4-4dd0-889d-fb34f602965a
-2024-12-14 16:30:20,797 - INFO - problem_instance short name: Ti_0
-2024-12-14 16:30:20,797 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:30:20,813 - INFO - Analyzing task ab61c91a-68ea-401f-a3ad-392e83ee802e...
-2024-12-14 16:30:20,813 - INFO - number of supporting files: 2
-2024-12-14 16:30:20,813 - INFO - supporting data file UUID: cdae3a0c-d613-4375-ab65-7088244b54ef.
-2024-12-14 16:30:20,813 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef.gz.
-2024-12-14 16:30:20,813 - INFO - assuming fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef.gz is an FCIDUMP file.
-2024-12-14 16:30:20,813 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef.gz...
-2024-12-14 16:30:20,820 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:30:21,477 - INFO - Authentication (publickey) successful!
-2024-12-14 16:30:21,492 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:30:22,558 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:30:27,465 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 16:30:27,465 - INFO - supporting data file UUID: 83c3df6f-5621-477f-8fad-7bddcb60c363.
-2024-12-14 16:30:27,465 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti0_vdz.83c3df6f-5621-477f-8fad-7bddcb60c363.chk.
-2024-12-14 16:30:27,465 - INFO - assuming Ti0_vdz.83c3df6f-5621-477f-8fad-7bddcb60c363.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:30:27,466 - INFO - Analyzing task 0c023ffe-8453-4f5f-b29e-7863589fb191...
-2024-12-14 16:30:27,466 - INFO - number of supporting files: 2
-2024-12-14 16:30:27,466 - INFO - supporting data file UUID: 7766bf7c-05db-4294-b125-6f0110aa9407.
-2024-12-14 16:30:27,466 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407.gz.
-2024-12-14 16:30:27,466 - INFO - assuming fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407.gz is an FCIDUMP file.
-2024-12-14 16:30:27,466 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407.gz...
-2024-12-14 16:30:27,472 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:30:28,129 - INFO - Authentication (publickey) successful!
-2024-12-14 16:30:28,144 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:30:57,943 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:31:26,868 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 16:31:26,868 - INFO - supporting data file UUID: 0eb3da83-59f1-46f9-9704-11784014a6c2.
-2024-12-14 16:31:26,868 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti0_vtz.0eb3da83-59f1-46f9-9704-11784014a6c2.chk.
-2024-12-14 16:31:26,868 - INFO - assuming Ti0_vtz.0eb3da83-59f1-46f9-9704-11784014a6c2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:31:26,873 - INFO - parsing ../problem_instances/problem_instance.CrO_0.2140edd4-8eb3-4270-b753-278334998e3d.json
-2024-12-14 16:31:26,874 - INFO - problem_instance UUID: 2140edd4-8eb3-4270-b753-278334998e3d
-2024-12-14 16:31:26,874 - INFO - problem_instance short name: CrO_0
-2024-12-14 16:31:26,874 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:31:26,890 - INFO - Analyzing task e0101b06-dfd6-4caa-8580-a9815b225204...
-2024-12-14 16:31:26,890 - INFO - number of supporting files: 2
-2024-12-14 16:31:26,890 - INFO - supporting data file UUID: b9a18106-c719-4d0c-af12-30ded772eb55.
-2024-12-14 16:31:26,890 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55.gz.
-2024-12-14 16:31:26,890 - INFO - assuming fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55.gz is an FCIDUMP file.
-2024-12-14 16:31:26,890 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55.gz...
-2024-12-14 16:31:26,896 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:31:27,548 - INFO - Authentication (publickey) successful!
-2024-12-14 16:31:27,563 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:31:32,165 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:31:43,098 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 16:31:43,098 - INFO - supporting data file UUID: 59764ee7-250e-4e06-89c7-e9cdc5850196.
-2024-12-14 16:31:43,098 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/CrO_vdz.59764ee7-250e-4e06-89c7-e9cdc5850196.chk.
-2024-12-14 16:31:43,098 - INFO - assuming CrO_vdz.59764ee7-250e-4e06-89c7-e9cdc5850196.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:31:43,100 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0002.00043d56-ed63-4266-907c-99c95c51b9db.json
-2024-12-14 16:31:43,101 - INFO - problem_instance UUID: 00043d56-ed63-4266-907c-99c95c51b9db
-2024-12-14 16:31:43,102 - INFO - problem_instance short name: planted_solution_0002
-2024-12-14 16:31:43,102 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:31:43,117 - INFO - Analyzing task 0deae366-42de-4081-914d-db85c6b47168...
-2024-12-14 16:31:43,117 - INFO - number of supporting files: 1
-2024-12-14 16:31:43,117 - INFO - supporting data file UUID: 16f9288f-be7e-4f8a-ab09-0153263f83c7.
-2024-12-14 16:31:43,117 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7.gz.
-2024-12-14 16:31:43,117 - INFO - assuming fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7.gz is an FCIDUMP file.
-2024-12-14 16:31:43,117 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7.gz...
-2024-12-14 16:31:43,122 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:31:43,742 - INFO - Authentication (publickey) successful!
-2024-12-14 16:31:43,758 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:31:46,875 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:31:55,639 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 16:31:55,640 - INFO - parsing ../problem_instances/problem_instance.h3_c_o_h_0.5524b5e5-adba-4322-9808-69e75e4335b2.json
-2024-12-14 16:31:55,641 - INFO - problem_instance UUID: 5524b5e5-adba-4322-9808-69e75e4335b2
-2024-12-14 16:31:55,641 - INFO - problem_instance short name: h3_c_o_h_0
-2024-12-14 16:31:55,641 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:31:55,656 - INFO - Analyzing task fc3586af-0290-4a4a-81e1-422a1d331a09...
-2024-12-14 16:31:55,656 - INFO - number of supporting files: 2
-2024-12-14 16:31:55,656 - INFO - supporting data file UUID: 26a32758-4c43-4add-a12e-7273b2ddfd0e.
-2024-12-14 16:31:55,656 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e.gz.
-2024-12-14 16:31:55,656 - INFO - assuming fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e.gz is an FCIDUMP file.
-2024-12-14 16:31:55,657 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e.gz...
-2024-12-14 16:31:55,662 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:31:56,320 - INFO - Authentication (publickey) successful!
-2024-12-14 16:31:56,337 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:31:56,777 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:31:59,396 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 16:31:59,397 - INFO - supporting data file UUID: fc9dd1d9-c83f-42c3-ac64-9d4b9d76800a.
-2024-12-14 16:31:59,397 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h3_c_o_h_cc-pVDZ.fc9dd1d9-c83f-42c3-ac64-9d4b9d76800a.chk.
-2024-12-14 16:31:59,397 - INFO - assuming h3_c_o_h_cc-pVDZ.fc9dd1d9-c83f-42c3-ac64-9d4b9d76800a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:31:59,397 - INFO - Analyzing task 7ecc9a42-2b18-4179-81ec-583598fa579b...
-2024-12-14 16:31:59,397 - INFO - number of supporting files: 2
-2024-12-14 16:31:59,397 - INFO - supporting data file UUID: 5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.
-2024-12-14 16:31:59,397 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.gz.
-2024-12-14 16:31:59,397 - INFO - assuming fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.gz is an FCIDUMP file.
-2024-12-14 16:31:59,397 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.gz...
-2024-12-14 16:31:59,403 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:32:00,044 - INFO - Authentication (publickey) successful!
-2024-12-14 16:32:00,061 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:36:01,658 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:37:25,163 - INFO - Skipping Logical Resource Estimate because number of orbitals (116) exceeds maximum specified in config (32).
-2024-12-14 16:37:25,164 - INFO - supporting data file UUID: 05a6c52b-f0b3-440a-9954-75e0df02795a.
-2024-12-14 16:37:25,164 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h3_c_o_h_cc-pVTZ.05a6c52b-f0b3-440a-9954-75e0df02795a.chk.
-2024-12-14 16:37:25,164 - INFO - assuming h3_c_o_h_cc-pVTZ.05a6c52b-f0b3-440a-9954-75e0df02795a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:37:25,179 - INFO - parsing ../problem_instances/problem_instance.Cr_0.b8fe08a4-82fe-4636-9812-b1e0666f95b5.json
-2024-12-14 16:37:25,179 - INFO - problem_instance UUID: b8fe08a4-82fe-4636-9812-b1e0666f95b5
-2024-12-14 16:37:25,179 - INFO - problem_instance short name: Cr_0
-2024-12-14 16:37:25,179 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:37:25,195 - INFO - Analyzing task 5d85532e-9116-48a1-9810-7925c9ed9c57...
-2024-12-14 16:37:25,195 - INFO - number of supporting files: 2
-2024-12-14 16:37:25,195 - INFO - supporting data file UUID: be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.
-2024-12-14 16:37:25,195 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.gz.
-2024-12-14 16:37:25,195 - INFO - assuming fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.gz is an FCIDUMP file.
-2024-12-14 16:37:25,195 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.gz...
-2024-12-14 16:37:25,200 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:37:25,832 - INFO - Authentication (publickey) successful!
-2024-12-14 16:37:25,850 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:37:28,282 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:37:35,581 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 16:37:35,581 - INFO - supporting data file UUID: 40f36526-3534-4688-8bd5-9cb9e1a8a6c8.
-2024-12-14 16:37:35,581 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr0_vdz.40f36526-3534-4688-8bd5-9cb9e1a8a6c8.chk.
-2024-12-14 16:37:35,581 - INFO - assuming Cr0_vdz.40f36526-3534-4688-8bd5-9cb9e1a8a6c8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:37:35,581 - INFO - Analyzing task 35b59fd4-e046-4d69-ba52-4b94a7777ac3...
-2024-12-14 16:37:35,581 - INFO - number of supporting files: 2
-2024-12-14 16:37:35,581 - INFO - supporting data file UUID: dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.
-2024-12-14 16:37:35,582 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.gz.
-2024-12-14 16:37:35,582 - INFO - assuming fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.gz is an FCIDUMP file.
-2024-12-14 16:37:35,582 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.gz...
-2024-12-14 16:37:35,587 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:37:36,225 - INFO - Authentication (publickey) successful!
-2024-12-14 16:37:36,241 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:39:05,044 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:39:56,126 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 16:39:56,126 - INFO - supporting data file UUID: 83f5e74f-7848-4b7d-8c79-85ff5e3ecd8a.
-2024-12-14 16:39:56,127 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr0_vtz.83f5e74f-7848-4b7d-8c79-85ff5e3ecd8a.chk.
-2024-12-14 16:39:56,127 - INFO - assuming Cr0_vtz.83f5e74f-7848-4b7d-8c79-85ff5e3ecd8a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:39:56,132 - INFO - parsing ../problem_instances/problem_instance.h2_o2_0.cc7044d7-28e0-4fe2-bd6b-c9c758da4776.json
-2024-12-14 16:39:56,132 - INFO - problem_instance UUID: cc7044d7-28e0-4fe2-bd6b-c9c758da4776
-2024-12-14 16:39:56,132 - INFO - problem_instance short name: h2_o2_0
-2024-12-14 16:39:56,132 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:39:56,148 - INFO - Analyzing task 85743547-31ba-48ff-b854-220e4b9b620f...
-2024-12-14 16:39:56,148 - INFO - number of supporting files: 2
-2024-12-14 16:39:56,148 - INFO - supporting data file UUID: 459b2739-8810-4cd9-82c4-4285c36a0193.
-2024-12-14 16:39:56,148 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193.gz.
-2024-12-14 16:39:56,148 - INFO - assuming fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193.gz is an FCIDUMP file.
-2024-12-14 16:39:56,148 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193.gz...
-2024-12-14 16:39:56,156 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:39:56,807 - INFO - Authentication (publickey) successful!
-2024-12-14 16:39:56,825 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:39:57,066 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:39:58,916 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 16:39:58,916 - INFO - supporting data file UUID: ba9db214-256b-4302-9fc3-53c07a2a38f7.
-2024-12-14 16:39:58,916 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o2_cc-pVDZ.ba9db214-256b-4302-9fc3-53c07a2a38f7.chk.
-2024-12-14 16:39:58,916 - INFO - assuming h2_o2_cc-pVDZ.ba9db214-256b-4302-9fc3-53c07a2a38f7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:39:58,916 - INFO - Analyzing task ae328238-7f54-43e2-bf9a-01c60563e578...
-2024-12-14 16:39:58,916 - INFO - number of supporting files: 2
-2024-12-14 16:39:58,916 - INFO - supporting data file UUID: 1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.
-2024-12-14 16:39:58,916 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.gz.
-2024-12-14 16:39:58,916 - INFO - assuming fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.gz is an FCIDUMP file.
-2024-12-14 16:39:58,916 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.gz...
-2024-12-14 16:39:58,921 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:39:59,578 - INFO - Authentication (publickey) successful!
-2024-12-14 16:39:59,593 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:41:32,360 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:42:24,306 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 16:42:24,306 - INFO - supporting data file UUID: a269bb23-789a-4e5d-95fb-79e799b7b57d.
-2024-12-14 16:42:24,306 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o2_cc-pVTZ.a269bb23-789a-4e5d-95fb-79e799b7b57d.chk.
-2024-12-14 16:42:24,306 - INFO - assuming h2_o2_cc-pVTZ.a269bb23-789a-4e5d-95fb-79e799b7b57d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:42:24,312 - INFO - parsing ../problem_instances/problem_instance.c_o_0.1c3155e0-3679-4eff-bed0-57a1082672c3.json
-2024-12-14 16:42:24,312 - INFO - problem_instance UUID: 1c3155e0-3679-4eff-bed0-57a1082672c3
-2024-12-14 16:42:24,312 - INFO - problem_instance short name: c_o_0
-2024-12-14 16:42:24,312 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:42:24,327 - INFO - Analyzing task 02588640-a5ae-48e6-b28b-f6759886ab70...
-2024-12-14 16:42:24,327 - INFO - number of supporting files: 2
-2024-12-14 16:42:24,327 - INFO - supporting data file UUID: 5de3dbbd-1d79-45c9-ac75-4140ae123baa.
-2024-12-14 16:42:24,328 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa.gz.
-2024-12-14 16:42:24,328 - INFO - assuming fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa.gz is an FCIDUMP file.
-2024-12-14 16:42:24,328 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa.gz...
-2024-12-14 16:42:24,334 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:42:25,015 - INFO - Authentication (publickey) successful!
-2024-12-14 16:42:25,031 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:42:25,111 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:42:25,358 - INFO - ===============================================
-2024-12-14 16:42:25,358 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 16:43:56,812 - INFO - Circuit initialization time: 91.454278 seconds.
-2024-12-14 16:43:56,813 - INFO - Estimating logical resources...
-2024-12-14 16:44:10,570 - INFO - Resource estimation time (seconds): 13.757683
-2024-12-14 16:44:10,571 - INFO - supporting data file UUID: b9b25ab0-9049-423b-b5e4-c2cb73ae60e8.
-2024-12-14 16:44:10,571 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o_cc-pVDZ.b9b25ab0-9049-423b-b5e4-c2cb73ae60e8.chk.
-2024-12-14 16:44:10,571 - INFO - assuming c_o_cc-pVDZ.b9b25ab0-9049-423b-b5e4-c2cb73ae60e8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:44:10,571 - INFO - Analyzing task 7ea61c79-c0e5-453b-8fd0-b176cb8821a7...
-2024-12-14 16:44:10,571 - INFO - number of supporting files: 2
-2024-12-14 16:44:10,571 - INFO - supporting data file UUID: 0c547725-1536-47b8-98f9-ed1384ceb939.
-2024-12-14 16:44:10,571 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939.gz.
-2024-12-14 16:44:10,571 - INFO - assuming fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939.gz is an FCIDUMP file.
-2024-12-14 16:44:10,571 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939.gz...
-2024-12-14 16:44:10,576 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:44:11,242 - INFO - Authentication (publickey) successful!
-2024-12-14 16:44:11,258 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:45:27,396 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:46:17,422 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 16:46:17,422 - INFO - supporting data file UUID: 4e162895-4ecb-4b39-80c8-f3b2327c3ca7.
-2024-12-14 16:46:17,422 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o_cc-pVQZ.4e162895-4ecb-4b39-80c8-f3b2327c3ca7.chk.
-2024-12-14 16:46:17,422 - INFO - assuming c_o_cc-pVQZ.4e162895-4ecb-4b39-80c8-f3b2327c3ca7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:46:17,422 - INFO - Analyzing task a92f6594-5ccc-4385-9cb5-8c21b4407dcf...
-2024-12-14 16:46:17,422 - INFO - number of supporting files: 2
-2024-12-14 16:46:17,422 - INFO - supporting data file UUID: 2b749f51-9ea9-41c4-9f67-e9c8334478c4.
-2024-12-14 16:46:17,422 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4.gz.
-2024-12-14 16:46:17,422 - INFO - assuming fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4.gz is an FCIDUMP file.
-2024-12-14 16:46:17,422 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4.gz...
-2024-12-14 16:46:17,427 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:46:18,102 - INFO - Authentication (publickey) successful!
-2024-12-14 16:46:18,119 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:46:19,449 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:46:24,139 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 16:46:24,139 - INFO - supporting data file UUID: 362780fa-e430-4477-abe0-cef3e01f4bc8.
-2024-12-14 16:46:24,139 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o_cc-pVTZ.362780fa-e430-4477-abe0-cef3e01f4bc8.chk.
-2024-12-14 16:46:24,139 - INFO - assuming c_o_cc-pVTZ.362780fa-e430-4477-abe0-cef3e01f4bc8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:46:24,141 - INFO - parsing ../problem_instances/problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
-2024-12-14 16:46:24,141 - INFO - problem_instance UUID: c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7
-2024-12-14 16:46:24,141 - INFO - problem_instance short name: Sc_1
-2024-12-14 16:46:24,142 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:46:24,156 - INFO - Analyzing task ca6f7678-0952-4fe4-83fe-c4455a682132...
-2024-12-14 16:46:24,157 - INFO - number of supporting files: 2
-2024-12-14 16:46:24,157 - INFO - supporting data file UUID: 75228927-fac3-4caf-9e09-1fdfe51098a3.
-2024-12-14 16:46:24,157 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz.
-2024-12-14 16:46:24,157 - INFO - assuming fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz is an FCIDUMP file.
-2024-12-14 16:46:24,157 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz...
-2024-12-14 16:46:24,163 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:46:24,815 - INFO - Authentication (publickey) successful!
-2024-12-14 16:46:24,833 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:46:25,042 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:46:26,958 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 16:46:26,959 - INFO - supporting data file UUID: 5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.
-2024-12-14 16:46:26,959 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk.
-2024-12-14 16:46:26,959 - INFO - assuming Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:46:26,959 - INFO - Analyzing task 10119019-eea2-45c9-a748-e206780c4235...
-2024-12-14 16:46:26,959 - INFO - number of supporting files: 2
-2024-12-14 16:46:26,959 - INFO - supporting data file UUID: cfc29172-5c9c-4e13-9a31-17895ed89c95.
-2024-12-14 16:46:26,959 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz.
-2024-12-14 16:46:26,959 - INFO - assuming fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz is an FCIDUMP file.
-2024-12-14 16:46:26,959 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz...
-2024-12-14 16:46:26,964 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:46:27,618 - INFO - Authentication (publickey) successful!
-2024-12-14 16:46:27,634 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:49:07,251 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:50:15,176 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-14 16:50:15,176 - INFO - supporting data file UUID: 49ba78c1-9c90-45ed-afe8-56cf76b89697.
-2024-12-14 16:50:15,176 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vqz.49ba78c1-9c90-45ed-afe8-56cf76b89697.chk.
-2024-12-14 16:50:15,176 - INFO - assuming Sc1_vqz.49ba78c1-9c90-45ed-afe8-56cf76b89697.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:50:15,176 - INFO - Analyzing task 78d5e5ba-0b2c-4cfe-92c5-f1c749150015...
-2024-12-14 16:50:15,176 - INFO - number of supporting files: 2
-2024-12-14 16:50:15,176 - INFO - supporting data file UUID: adfdddd9-6ebe-4661-8bd8-c8810f117a6a.
-2024-12-14 16:50:15,176 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz.
-2024-12-14 16:50:15,176 - INFO - assuming fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz is an FCIDUMP file.
-2024-12-14 16:50:15,177 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz...
-2024-12-14 16:50:15,181 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:50:15,838 - INFO - Authentication (publickey) successful!
-2024-12-14 16:50:15,851 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:50:23,524 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:50:35,717 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 16:50:35,717 - INFO - supporting data file UUID: 01a9aae3-1545-469e-8816-eda173836278.
-2024-12-14 16:50:35,717 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vtz.01a9aae3-1545-469e-8816-eda173836278.chk.
-2024-12-14 16:50:35,717 - INFO - assuming Sc1_vtz.01a9aae3-1545-469e-8816-eda173836278.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:50:35,723 - INFO - parsing ../problem_instances/problem_instance.si_h2_singlet_0.a0a07bfe-aac2-4d61-9425-009953899b3b.json
-2024-12-14 16:50:35,724 - INFO - problem_instance UUID: a0a07bfe-aac2-4d61-9425-009953899b3b
-2024-12-14 16:50:35,724 - INFO - problem_instance short name: si_h2_singlet_0
-2024-12-14 16:50:35,724 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:50:35,739 - INFO - Analyzing task 240f7830-f4e1-4301-b0af-ab8936851796...
-2024-12-14 16:50:35,740 - INFO - number of supporting files: 2
-2024-12-14 16:50:35,740 - INFO - supporting data file UUID: 7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.
-2024-12-14 16:50:35,740 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.gz.
-2024-12-14 16:50:35,740 - INFO - assuming fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.gz is an FCIDUMP file.
-2024-12-14 16:50:35,740 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.gz...
-2024-12-14 16:50:35,745 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:50:36,400 - INFO - Authentication (publickey) successful!
-2024-12-14 16:50:36,415 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:50:36,485 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:50:36,689 - INFO - ===============================================
-2024-12-14 16:50:36,689 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 16:52:00,343 - INFO - Circuit initialization time: 83.654342 seconds.
-2024-12-14 16:52:00,343 - INFO - Estimating logical resources...
-2024-12-14 16:52:18,127 - INFO - Resource estimation time (seconds): 17.783368
-2024-12-14 16:52:18,127 - INFO - supporting data file UUID: d08c3329-01e1-46ce-b57b-25dfe315271e.
-2024-12-14 16:52:18,127 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h2_singlet_cc-pVDZ.d08c3329-01e1-46ce-b57b-25dfe315271e.chk.
-2024-12-14 16:52:18,127 - INFO - assuming si_h2_singlet_cc-pVDZ.d08c3329-01e1-46ce-b57b-25dfe315271e.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:52:18,127 - INFO - Analyzing task 50de76ad-110a-4c09-836a-64cc60c87f9a...
-2024-12-14 16:52:18,127 - INFO - number of supporting files: 2
-2024-12-14 16:52:18,127 - INFO - supporting data file UUID: 5b274001-6cd6-436f-995f-d460d33688da.
-2024-12-14 16:52:18,128 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da.gz.
-2024-12-14 16:52:18,128 - INFO - assuming fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da.gz is an FCIDUMP file.
-2024-12-14 16:52:18,128 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da.gz...
-2024-12-14 16:52:18,133 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:52:18,761 - INFO - Authentication (publickey) successful!
-2024-12-14 16:52:18,776 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:54:32,185 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:55:32,735 - INFO - Skipping Logical Resource Estimate because number of orbitals (119) exceeds maximum specified in config (32).
-2024-12-14 16:55:32,736 - INFO - supporting data file UUID: b3da1264-d9ac-4834-bb78-01627f2b23d8.
-2024-12-14 16:55:32,736 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h2_singlet_cc-pVQZ.b3da1264-d9ac-4834-bb78-01627f2b23d8.chk.
-2024-12-14 16:55:32,736 - INFO - assuming si_h2_singlet_cc-pVQZ.b3da1264-d9ac-4834-bb78-01627f2b23d8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:55:32,737 - INFO - Analyzing task 5e1dcd34-1373-4f34-b9df-d738a8cf4db6...
-2024-12-14 16:55:32,737 - INFO - number of supporting files: 2
-2024-12-14 16:55:32,737 - INFO - supporting data file UUID: 0534fd24-c760-462e-b288-c3ea9fe721c8.
-2024-12-14 16:55:32,737 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8.gz.
-2024-12-14 16:55:32,738 - INFO - assuming fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8.gz is an FCIDUMP file.
-2024-12-14 16:55:32,738 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8.gz...
-2024-12-14 16:55:32,743 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:55:33,396 - INFO - Authentication (publickey) successful!
-2024-12-14 16:55:33,412 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:55:34,511 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:55:39,799 - INFO - Skipping Logical Resource Estimate because number of orbitals (62) exceeds maximum specified in config (32).
-2024-12-14 16:55:39,799 - INFO - supporting data file UUID: fd38acc2-879f-4343-9948-f08f6e83f44c.
-2024-12-14 16:55:39,799 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h2_singlet_cc-pVTZ.fd38acc2-879f-4343-9948-f08f6e83f44c.chk.
-2024-12-14 16:55:39,800 - INFO - assuming si_h2_singlet_cc-pVTZ.fd38acc2-879f-4343-9948-f08f6e83f44c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:55:39,801 - INFO - parsing ../problem_instances/problem_instance.c_s_0.f90280cc-c860-4ff1-a9ec-4841cec989f7.json
-2024-12-14 16:55:39,802 - INFO - problem_instance UUID: f90280cc-c860-4ff1-a9ec-4841cec989f7
-2024-12-14 16:55:39,802 - INFO - problem_instance short name: c_s_0
-2024-12-14 16:55:39,802 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:55:39,817 - INFO - Analyzing task 886855d3-f1a7-4004-a736-417360e81d0a...
-2024-12-14 16:55:39,817 - INFO - number of supporting files: 2
-2024-12-14 16:55:39,817 - INFO - supporting data file UUID: 1c5f7390-3d26-4730-addd-b0fbd7591169.
-2024-12-14 16:55:39,817 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169.gz.
-2024-12-14 16:55:39,817 - INFO - assuming fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169.gz is an FCIDUMP file.
-2024-12-14 16:55:39,817 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169.gz...
-2024-12-14 16:55:39,823 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:55:40,470 - INFO - Authentication (publickey) successful!
-2024-12-14 16:55:40,485 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:55:40,651 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:55:41,252 - INFO - ===============================================
-2024-12-14 16:55:41,252 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:00:05,003 - INFO - Circuit initialization time: 263.750947 seconds.
-2024-12-14 17:00:05,004 - INFO - Estimating logical resources...
-2024-12-14 17:00:34,108 - INFO - Resource estimation time (seconds): 29.104516
-2024-12-14 17:00:34,108 - INFO - supporting data file UUID: 402d1cfc-3809-48f1-8c2a-5c3faa18bdf8.
-2024-12-14 17:00:34,108 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_s_cc-pVDZ.402d1cfc-3809-48f1-8c2a-5c3faa18bdf8.chk.
-2024-12-14 17:00:34,108 - INFO - assuming c_s_cc-pVDZ.402d1cfc-3809-48f1-8c2a-5c3faa18bdf8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:00:34,109 - INFO - Analyzing task 57830810-1133-4c19-9a19-30183dd86a9f...
-2024-12-14 17:00:34,109 - INFO - number of supporting files: 2
-2024-12-14 17:00:34,109 - INFO - supporting data file UUID: f895f408-4aa7-47e2-a903-c26b963b399e.
-2024-12-14 17:00:34,109 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e.gz.
-2024-12-14 17:00:34,109 - INFO - assuming fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e.gz is an FCIDUMP file.
-2024-12-14 17:00:34,109 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e.gz...
-2024-12-14 17:00:34,116 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:00:34,769 - INFO - Authentication (publickey) successful!
-2024-12-14 17:00:34,787 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:00:43,205 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:00:57,394 - INFO - Skipping Logical Resource Estimate because number of orbitals (64) exceeds maximum specified in config (32).
-2024-12-14 17:00:57,394 - INFO - supporting data file UUID: 3e7f8c2d-ae2e-446c-99ff-3366d03c24d5.
-2024-12-14 17:00:57,394 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_s_cc-pVTZ.3e7f8c2d-ae2e-446c-99ff-3366d03c24d5.chk.
-2024-12-14 17:00:57,394 - INFO - assuming c_s_cc-pVTZ.3e7f8c2d-ae2e-446c-99ff-3366d03c24d5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:00:57,396 - INFO - parsing ../problem_instances/problem_instance.h3_c_s_h_0.674b572a-3d6d-4418-8cc2-4755d90367ee.json
-2024-12-14 17:00:57,397 - INFO - problem_instance UUID: 674b572a-3d6d-4418-8cc2-4755d90367ee
-2024-12-14 17:00:57,397 - INFO - problem_instance short name: h3_c_s_h_0
-2024-12-14 17:00:57,397 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:00:57,413 - INFO - Analyzing task ff159145-fd97-486b-bf16-fc766b362ea3...
-2024-12-14 17:00:57,413 - INFO - number of supporting files: 2
-2024-12-14 17:00:57,413 - INFO - supporting data file UUID: 65a71ea2-097e-472c-b96a-13ddf6a0962c.
-2024-12-14 17:00:57,413 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c.gz.
-2024-12-14 17:00:57,413 - INFO - assuming fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c.gz is an FCIDUMP file.
-2024-12-14 17:00:57,413 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c.gz...
-2024-12-14 17:00:57,418 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:00:58,088 - INFO - Authentication (publickey) successful!
-2024-12-14 17:00:58,103 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:00:58,769 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:01:02,543 - INFO - Skipping Logical Resource Estimate because number of orbitals (52) exceeds maximum specified in config (32).
-2024-12-14 17:01:02,543 - INFO - supporting data file UUID: 2286fa4e-2324-4f1f-990e-6b397286e4d2.
-2024-12-14 17:01:02,543 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h3_c_s_h_cc-pVDZ.2286fa4e-2324-4f1f-990e-6b397286e4d2.chk.
-2024-12-14 17:01:02,543 - INFO - assuming h3_c_s_h_cc-pVDZ.2286fa4e-2324-4f1f-990e-6b397286e4d2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:01:02,545 - INFO - parsing ../problem_instances/problem_instance.h_cl_0.586ce6a9-1876-459e-9b6c-be8bb1c4d1a5.json
-2024-12-14 17:01:02,545 - INFO - problem_instance UUID: 586ce6a9-1876-459e-9b6c-be8bb1c4d1a5
-2024-12-14 17:01:02,545 - INFO - problem_instance short name: h_cl_0
-2024-12-14 17:01:02,545 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 17:01:02,570 - INFO - Analyzing task fa3bc2a8-8067-4088-909a-2ddfa655ebfb...
-2024-12-14 17:01:02,570 - INFO - number of supporting files: 2
-2024-12-14 17:01:02,570 - INFO - supporting data file UUID: 5373214f-f344-4bdb-8840-5acf3b4c07c2.
-2024-12-14 17:01:02,570 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2.gz.
-2024-12-14 17:01:02,570 - INFO - assuming fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2.gz is an FCIDUMP file.
-2024-12-14 17:01:02,570 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2.gz...
-2024-12-14 17:01:02,577 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:01:03,081 - INFO - Authentication (publickey) successful!
-2024-12-14 17:01:03,103 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:01:03,492 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:01:03,615 - INFO - ===============================================
-2024-12-14 17:01:03,615 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:01:50,961 - INFO - Circuit initialization time: 47.345955 seconds.
-2024-12-14 17:01:50,961 - INFO - Estimating logical resources...
-2024-12-14 17:02:00,568 - INFO - Resource estimation time (seconds): 9.606271
-2024-12-14 17:02:00,568 - INFO - supporting data file UUID: 9d3c908b-f4dd-48a9-9c0b-2091b75c4f71.
-2024-12-14 17:02:00,568 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_cl_cc-pVDZ.9d3c908b-f4dd-48a9-9c0b-2091b75c4f71.chk.
-2024-12-14 17:02:00,568 - INFO - assuming h_cl_cc-pVDZ.9d3c908b-f4dd-48a9-9c0b-2091b75c4f71.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:02:00,568 - INFO - Analyzing task 8f39fc4f-91dc-4f67-ab5c-00e8ffc866c4...
-2024-12-14 17:02:00,568 - INFO - number of supporting files: 2
-2024-12-14 17:02:00,568 - INFO - supporting data file UUID: 1235d3d0-2c41-4036-909c-807ed3c89d96.
-2024-12-14 17:02:00,568 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96.gz.
-2024-12-14 17:02:00,568 - INFO - assuming fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96.gz is an FCIDUMP file.
-2024-12-14 17:02:00,568 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96.gz...
-2024-12-14 17:02:00,574 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:02:01,229 - INFO - Authentication (publickey) successful!
-2024-12-14 17:02:01,247 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:02:23,228 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:02:48,697 - INFO - Skipping Logical Resource Estimate because number of orbitals (89) exceeds maximum specified in config (32).
-2024-12-14 17:02:48,697 - INFO - supporting data file UUID: bb5112e8-2e25-44c8-b20c-55f6a6f5a9e5.
-2024-12-14 17:02:48,697 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_cl_cc-pVQZ.bb5112e8-2e25-44c8-b20c-55f6a6f5a9e5.chk.
-2024-12-14 17:02:48,697 - INFO - assuming h_cl_cc-pVQZ.bb5112e8-2e25-44c8-b20c-55f6a6f5a9e5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:02:48,697 - INFO - Analyzing task f0637f33-3c53-4f01-8cf7-cfd9c6f39a51...
-2024-12-14 17:02:48,697 - INFO - number of supporting files: 2
-2024-12-14 17:02:48,697 - INFO - supporting data file UUID: 9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.
-2024-12-14 17:02:48,697 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.gz.
-2024-12-14 17:02:48,698 - INFO - assuming fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.gz is an FCIDUMP file.
-2024-12-14 17:02:48,698 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.gz...
-2024-12-14 17:02:48,702 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:02:49,362 - INFO - Authentication (publickey) successful!
-2024-12-14 17:02:49,375 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:02:49,622 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:02:51,825 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 17:02:51,825 - INFO - supporting data file UUID: 438599fa-dfe3-43b1-b0d9-e3d94412d2bb.
-2024-12-14 17:02:51,825 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_cl_cc-pVTZ.438599fa-dfe3-43b1-b0d9-e3d94412d2bb.chk.
-2024-12-14 17:02:51,825 - INFO - assuming h_cl_cc-pVTZ.438599fa-dfe3-43b1-b0d9-e3d94412d2bb.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:02:51,827 - INFO - parsing ../problem_instances/problem_instance.s_o2_0.1d0b8322-24b3-407a-8246-07444bb020be.json
-2024-12-14 17:02:51,827 - INFO - problem_instance UUID: 1d0b8322-24b3-407a-8246-07444bb020be
-2024-12-14 17:02:51,827 - INFO - problem_instance short name: s_o2_0
-2024-12-14 17:02:51,827 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 17:02:51,842 - INFO - Analyzing task c7cd47fa-1bbd-4859-a0c8-3fd5c287c6db...
-2024-12-14 17:02:51,842 - INFO - number of supporting files: 2
-2024-12-14 17:02:51,842 - INFO - supporting data file UUID: 42f8e26e-4707-41e4-8b0a-c099a8a4145c.
-2024-12-14 17:02:51,842 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c.gz.
-2024-12-14 17:02:51,842 - INFO - assuming fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c.gz is an FCIDUMP file.
-2024-12-14 17:02:51,842 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c.gz...
-2024-12-14 17:02:51,847 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:02:52,512 - INFO - Authentication (publickey) successful!
-2024-12-14 17:02:52,528 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:02:53,090 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:02:55,831 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 17:02:55,831 - INFO - supporting data file UUID: 8fff4715-cce7-4f70-8fda-582dc3ce714f.
-2024-12-14 17:02:55,831 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/s_o2_cc-pVDZ.8fff4715-cce7-4f70-8fda-582dc3ce714f.chk.
-2024-12-14 17:02:55,831 - INFO - assuming s_o2_cc-pVDZ.8fff4715-cce7-4f70-8fda-582dc3ce714f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:02:55,831 - INFO - Analyzing task 84243fc5-4284-4393-bb1d-b73bf600eb26...
-2024-12-14 17:02:55,831 - INFO - number of supporting files: 2
-2024-12-14 17:02:55,831 - INFO - supporting data file UUID: 189ad642-9d0f-4d5a-a1b3-1160f515ebf4.
-2024-12-14 17:02:55,831 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4.gz.
-2024-12-14 17:02:55,831 - INFO - assuming fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4.gz is an FCIDUMP file.
-2024-12-14 17:02:55,831 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4.gz...
-2024-12-14 17:02:55,838 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:02:56,462 - INFO - Authentication (publickey) successful!
-2024-12-14 17:02:56,475 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:03:54,457 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:04:34,531 - INFO - Skipping Logical Resource Estimate because number of orbitals (94) exceeds maximum specified in config (32).
-2024-12-14 17:04:34,531 - INFO - supporting data file UUID: f97e0487-8e45-4652-9e7f-911e68fa341b.
-2024-12-14 17:04:34,531 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/s_o2_cc-pVTZ.f97e0487-8e45-4652-9e7f-911e68fa341b.chk.
-2024-12-14 17:04:34,532 - INFO - assuming s_o2_cc-pVTZ.f97e0487-8e45-4652-9e7f-911e68fa341b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:04:34,539 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0004.e0adafc5-789e-43e6-8f9e-e718da28de3a.json
-2024-12-14 17:04:34,705 - INFO - problem_instance UUID: e0adafc5-789e-43e6-8f9e-e718da28de3a
-2024-12-14 17:04:34,705 - INFO - problem_instance short name: planted_solution_0004
-2024-12-14 17:04:34,705 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:04:34,726 - INFO - Analyzing task c9809448-2f3d-40d4-858d-6288a4703af4...
-2024-12-14 17:04:34,726 - INFO - number of supporting files: 1
-2024-12-14 17:04:34,726 - INFO - supporting data file UUID: 52ddfe55-8758-448b-a6b1-3afdab85fdf4.
-2024-12-14 17:04:34,726 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4.gz.
-2024-12-14 17:04:34,726 - INFO - assuming fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4.gz is an FCIDUMP file.
-2024-12-14 17:04:34,726 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4.gz...
-2024-12-14 17:04:34,732 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:04:35,404 - INFO - Authentication (publickey) successful!
-2024-12-14 17:04:35,419 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:04:38,627 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:04:47,880 - INFO - Skipping Logical Resource Estimate because number of orbitals (70) exceeds maximum specified in config (32).
-2024-12-14 17:04:47,882 - INFO - parsing ../problem_instances/problem_instance.O_0.162f41da-af43-427c-a8bc-ae9fa97ace95.json
-2024-12-14 17:04:47,883 - INFO - problem_instance UUID: 162f41da-af43-427c-a8bc-ae9fa97ace95
-2024-12-14 17:04:47,883 - INFO - problem_instance short name: O_0
-2024-12-14 17:04:47,883 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 17:04:47,898 - INFO - Analyzing task 402d5237-16a3-4eb8-8bd4-5dcf2cb14c36...
-2024-12-14 17:04:47,898 - INFO - number of supporting files: 2
-2024-12-14 17:04:47,898 - INFO - supporting data file UUID: c3e26bde-f8e2-4e34-a833-9176dc6c5d58.
-2024-12-14 17:04:47,898 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58.gz.
-2024-12-14 17:04:47,898 - INFO - assuming fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58.gz is an FCIDUMP file.
-2024-12-14 17:04:47,898 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58.gz...
-2024-12-14 17:04:47,903 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:04:48,539 - INFO - Authentication (publickey) successful!
-2024-12-14 17:04:48,553 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:04:48,627 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:04:48,730 - INFO - ===============================================
-2024-12-14 17:04:48,730 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:05:11,239 - INFO - Circuit initialization time: 22.508807 seconds.
-2024-12-14 17:05:11,239 - INFO - Estimating logical resources...
-2024-12-14 17:05:19,238 - INFO - Resource estimation time (seconds): 7.99902
-2024-12-14 17:05:19,239 - INFO - supporting data file UUID: ea4019d6-415e-4efd-8627-d973327ce19e.
-2024-12-14 17:05:19,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O0_vdz.ea4019d6-415e-4efd-8627-d973327ce19e.chk.
-2024-12-14 17:05:19,239 - INFO - assuming O0_vdz.ea4019d6-415e-4efd-8627-d973327ce19e.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:05:19,239 - INFO - Analyzing task b4e88a1e-f05f-4ff7-bd91-b24a5073c6ca...
-2024-12-14 17:05:19,239 - INFO - number of supporting files: 2
-2024-12-14 17:05:19,239 - INFO - supporting data file UUID: 31ade416-8bd1-4671-953c-c62f281cd96d.
-2024-12-14 17:05:19,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d.gz.
-2024-12-14 17:05:19,239 - INFO - assuming fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d.gz is an FCIDUMP file.
-2024-12-14 17:05:19,239 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d.gz...
-2024-12-14 17:05:19,244 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:19,952 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:19,967 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:05:23,311 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:05:33,162 - INFO - Skipping Logical Resource Estimate because number of orbitals (79) exceeds maximum specified in config (32).
-2024-12-14 17:05:33,162 - INFO - supporting data file UUID: 2b1cc7fa-5247-4518-8fdb-3e467de4c483.
-2024-12-14 17:05:33,162 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O0_vqz.2b1cc7fa-5247-4518-8fdb-3e467de4c483.chk.
-2024-12-14 17:05:33,162 - INFO - assuming O0_vqz.2b1cc7fa-5247-4518-8fdb-3e467de4c483.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:05:33,162 - INFO - Analyzing task 85a3a8d6-f2c7-458c-bbc3-25fd76d9afc0...
-2024-12-14 17:05:33,162 - INFO - number of supporting files: 2
-2024-12-14 17:05:33,162 - INFO - supporting data file UUID: 1661aaae-621a-430d-990a-bcbbbe270dfb.
-2024-12-14 17:05:33,162 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb.gz.
-2024-12-14 17:05:33,162 - INFO - assuming fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb.gz is an FCIDUMP file.
-2024-12-14 17:05:33,162 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb.gz...
-2024-12-14 17:05:33,167 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:33,824 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:33,842 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:05:33,949 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:05:34,941 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:05:34,941 - INFO - supporting data file UUID: dad8825d-6a27-4f7f-87a6-4bcfad39bdb9.
-2024-12-14 17:05:34,941 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O0_vtz.dad8825d-6a27-4f7f-87a6-4bcfad39bdb9.chk.
-2024-12-14 17:05:34,941 - INFO - assuming O0_vtz.dad8825d-6a27-4f7f-87a6-4bcfad39bdb9.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:05:34,943 - INFO - parsing ../problem_instances/problem_instance.ozone.9560107e-f1ad-4480-aa51-ef03edda6e19.json
-2024-12-14 17:05:34,943 - INFO - problem_instance UUID: 9560107e-f1ad-4480-aa51-ef03edda6e19
-2024-12-14 17:05:34,943 - INFO - problem_instance short name: ozone
-2024-12-14 17:05:34,943 - INFO - contains 6 associated Hamiltonians.
-2024-12-14 17:05:34,958 - INFO - Analyzing task 881f5275-83eb-470c-80fe-eebb7ced30e9...
-2024-12-14 17:05:34,958 - INFO - number of supporting files: 1
-2024-12-14 17:05:34,958 - INFO - supporting data file UUID: b0c72570-cf06-4ecc-ae64-52a65720c849.
-2024-12-14 17:05:34,958 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849.gz.
-2024-12-14 17:05:34,959 - INFO - assuming FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849.gz is an FCIDUMP file.
-2024-12-14 17:05:34,959 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849.gz...
-2024-12-14 17:05:34,964 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:35,597 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:35,615 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:05:35,797 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:05:37,238 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 17:05:37,238 - INFO - Analyzing task e0de65ed-e45e-46e0-a57b-c6ad4efbdafe...
-2024-12-14 17:05:37,238 - INFO - number of supporting files: 1
-2024-12-14 17:05:37,239 - INFO - supporting data file UUID: 598f7475-c056-4a46-8d20-5159c73e5d02.
-2024-12-14 17:05:37,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02.gz.
-2024-12-14 17:05:37,239 - INFO - assuming FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02.gz is an FCIDUMP file.
-2024-12-14 17:05:37,239 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02.gz...
-2024-12-14 17:05:37,244 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:37,903 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:37,919 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:05:37,980 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:05:38,007 - INFO - ===============================================
-2024-12-14 17:05:38,007 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:05:47,402 - INFO - Circuit initialization time: 9.394373 seconds.
-2024-12-14 17:05:47,402 - INFO - Estimating logical resources...
-2024-12-14 17:05:50,596 - INFO - Resource estimation time (seconds): 3.193997
-2024-12-14 17:05:50,596 - INFO - Analyzing task 6918e02b-1e04-40bf-a800-1c9ed100d261...
-2024-12-14 17:05:50,596 - INFO - number of supporting files: 1
-2024-12-14 17:05:50,596 - INFO - supporting data file UUID: 8fc9b179-ff7d-4402-b0cf-18ec074b211a.
-2024-12-14 17:05:50,597 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a.gz.
-2024-12-14 17:05:50,597 - INFO - assuming FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a.gz is an FCIDUMP file.
-2024-12-14 17:05:50,597 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a.gz...
-2024-12-14 17:05:50,602 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:51,273 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:51,290 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:06:16,838 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:06:38,318 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 17:06:38,318 - INFO - Analyzing task a2ad41b8-37bb-44e1-be3e-df1052952e9c...
-2024-12-14 17:06:38,318 - INFO - number of supporting files: 1
-2024-12-14 17:06:38,318 - INFO - supporting data file UUID: 1a42101c-3c00-4105-8ed3-9275bf0d18db.
-2024-12-14 17:06:38,318 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db.gz.
-2024-12-14 17:06:38,318 - INFO - assuming FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db.gz is an FCIDUMP file.
-2024-12-14 17:06:38,318 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db.gz...
-2024-12-14 17:06:38,327 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:06:39,006 - INFO - Authentication (publickey) successful!
-2024-12-14 17:06:39,020 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:06:39,180 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:06:40,528 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 17:06:40,528 - INFO - Analyzing task b4968ccd-6711-4173-8f80-f16094b3e0cd...
-2024-12-14 17:06:40,528 - INFO - number of supporting files: 1
-2024-12-14 17:06:40,529 - INFO - supporting data file UUID: 93698b08-3188-4961-b551-50ac2c1e62b3.
-2024-12-14 17:06:40,529 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3.gz.
-2024-12-14 17:06:40,529 - INFO - assuming FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3.gz is an FCIDUMP file.
-2024-12-14 17:06:40,529 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3.gz...
-2024-12-14 17:06:40,535 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:06:41,190 - INFO - Authentication (publickey) successful!
-2024-12-14 17:06:41,207 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:06:41,290 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:06:41,325 - INFO - ===============================================
-2024-12-14 17:06:41,325 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:06:50,396 - INFO - Circuit initialization time: 9.070894 seconds.
-2024-12-14 17:06:50,396 - INFO - Estimating logical resources...
-2024-12-14 17:06:53,482 - INFO - Resource estimation time (seconds): 3.086139
-2024-12-14 17:06:53,482 - INFO - Analyzing task ee2925f1-a302-4c21-b33c-5cb30b10270f...
-2024-12-14 17:06:53,483 - INFO - number of supporting files: 1
-2024-12-14 17:06:53,483 - INFO - supporting data file UUID: 8b6ad6f7-f004-4941-95b2-829eb3723c8d.
-2024-12-14 17:06:53,483 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d.gz.
-2024-12-14 17:06:53,483 - INFO - assuming FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d.gz is an FCIDUMP file.
-2024-12-14 17:06:53,483 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d.gz...
-2024-12-14 17:06:53,488 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:06:54,162 - INFO - Authentication (publickey) successful!
-2024-12-14 17:06:54,177 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:07:17,634 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:07:43,783 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 17:07:43,790 - INFO - parsing ../problem_instances/problem_instance.c_h2_singlet_0.7ca1486c-06a5-47c1-b8ab-eab491ffc68b.json
-2024-12-14 17:07:43,790 - INFO - problem_instance UUID: 7ca1486c-06a5-47c1-b8ab-eab491ffc68b
-2024-12-14 17:07:43,790 - INFO - problem_instance short name: c_h2_singlet_0
-2024-12-14 17:07:43,790 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 17:07:43,806 - INFO - Analyzing task 5f0ac7ac-1dcc-46a6-bfa0-6e76c73a0bdd...
-2024-12-14 17:07:43,806 - INFO - number of supporting files: 2
-2024-12-14 17:07:43,806 - INFO - supporting data file UUID: 290cfb48-dbdd-4915-bbaf-b0bc69fa070c.
-2024-12-14 17:07:43,806 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c.gz.
-2024-12-14 17:07:43,806 - INFO - assuming fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c.gz is an FCIDUMP file.
-2024-12-14 17:07:43,806 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c.gz...
-2024-12-14 17:07:43,815 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:07:44,466 - INFO - Authentication (publickey) successful!
-2024-12-14 17:07:44,482 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:07:44,559 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:07:44,647 - INFO - ===============================================
-2024-12-14 17:07:44,647 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:08:33,929 - INFO - Circuit initialization time: 49.281288 seconds.
-2024-12-14 17:08:33,929 - INFO - Estimating logical resources...
-2024-12-14 17:08:45,865 - INFO - Resource estimation time (seconds): 11.936132
-2024-12-14 17:08:45,865 - INFO - supporting data file UUID: c8a8bb7f-6183-4ee2-83f9-ca7dc4127c36.
-2024-12-14 17:08:45,865 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h2_singlet_cc-pVDZ.c8a8bb7f-6183-4ee2-83f9-ca7dc4127c36.chk.
-2024-12-14 17:08:45,866 - INFO - assuming c_h2_singlet_cc-pVDZ.c8a8bb7f-6183-4ee2-83f9-ca7dc4127c36.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:08:45,866 - INFO - Analyzing task 6a16e45d-545d-4827-9617-3c83fb323a97...
-2024-12-14 17:08:45,866 - INFO - number of supporting files: 2
-2024-12-14 17:08:45,866 - INFO - supporting data file UUID: 7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.
-2024-12-14 17:08:45,866 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.gz.
-2024-12-14 17:08:45,866 - INFO - assuming fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.gz is an FCIDUMP file.
-2024-12-14 17:08:45,866 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.gz...
-2024-12-14 17:08:45,871 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:08:46,526 - INFO - Authentication (publickey) successful!
-2024-12-14 17:08:46,540 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:10:07,438 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:10:51,443 - INFO - Skipping Logical Resource Estimate because number of orbitals (115) exceeds maximum specified in config (32).
-2024-12-14 17:10:51,443 - INFO - supporting data file UUID: 755431d2-689c-4d9f-a421-8b19082b1d8d.
-2024-12-14 17:10:51,443 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h2_singlet_cc-pVQZ.755431d2-689c-4d9f-a421-8b19082b1d8d.chk.
-2024-12-14 17:10:51,443 - INFO - assuming c_h2_singlet_cc-pVQZ.755431d2-689c-4d9f-a421-8b19082b1d8d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:10:51,443 - INFO - Analyzing task 8fa0ddcf-9b98-4144-8250-522f38c28b02...
-2024-12-14 17:10:51,443 - INFO - number of supporting files: 2
-2024-12-14 17:10:51,443 - INFO - supporting data file UUID: 59fca8b4-25f4-44f7-b961-34d6a4037051.
-2024-12-14 17:10:51,443 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051.gz.
-2024-12-14 17:10:51,443 - INFO - assuming fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051.gz is an FCIDUMP file.
-2024-12-14 17:10:51,443 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051.gz...
-2024-12-14 17:10:51,447 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:10:52,074 - INFO - Authentication (publickey) successful!
-2024-12-14 17:10:52,092 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:10:52,555 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:10:54,416 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 17:10:54,416 - INFO - supporting data file UUID: 3accd35c-ae52-4f9b-9a98-a9069b1768d3.
-2024-12-14 17:10:54,416 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h2_singlet_cc-pVTZ.3accd35c-ae52-4f9b-9a98-a9069b1768d3.chk.
-2024-12-14 17:10:54,417 - INFO - assuming c_h2_singlet_cc-pVTZ.3accd35c-ae52-4f9b-9a98-a9069b1768d3.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:10:54,418 - INFO - parsing ../problem_instances/problem_instance.VO_0.bcc86483-2a7e-4271-b6fc-238ef5e682f6.json
-2024-12-14 17:10:54,418 - INFO - problem_instance UUID: bcc86483-2a7e-4271-b6fc-238ef5e682f6
-2024-12-14 17:10:54,418 - INFO - problem_instance short name: VO_0
-2024-12-14 17:10:54,418 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:10:54,428 - INFO - Analyzing task 63c089b2-1940-4301-89d6-93ecc98c07f1...
-2024-12-14 17:10:54,428 - INFO - number of supporting files: 2
-2024-12-14 17:10:54,428 - INFO - supporting data file UUID: c6137fbe-c5ef-4572-9e3a-3261e9acaca0.
-2024-12-14 17:10:54,428 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0.gz.
-2024-12-14 17:10:54,429 - INFO - assuming fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0.gz is an FCIDUMP file.
-2024-12-14 17:10:54,429 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0.gz...
-2024-12-14 17:10:54,434 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:10:55,096 - INFO - Authentication (publickey) successful!
-2024-12-14 17:10:55,112 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:11:22,867 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:11:50,687 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 17:11:50,687 - INFO - supporting data file UUID: 033989fa-5cc5-4ca2-8e7a-a567b823a18f.
-2024-12-14 17:11:50,687 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/VO_vdz.033989fa-5cc5-4ca2-8e7a-a567b823a18f.chk.
-2024-12-14 17:11:50,687 - INFO - assuming VO_vdz.033989fa-5cc5-4ca2-8e7a-a567b823a18f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:11:50,689 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0005.7e0fb928-b0a9-4b44-89f1-7e0ee3b2bb13.json
-2024-12-14 17:11:50,691 - INFO - problem_instance UUID: 7e0fb928-b0a9-4b44-89f1-7e0ee3b2bb13
-2024-12-14 17:11:50,691 - INFO - problem_instance short name: planted_solution_0005
-2024-12-14 17:11:50,691 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:11:50,706 - INFO - Analyzing task a41a284c-7baa-438e-9323-532091c7a78f...
-2024-12-14 17:11:50,707 - INFO - number of supporting files: 1
-2024-12-14 17:11:50,707 - INFO - supporting data file UUID: 0ddeaaab-a6ef-436b-8189-290afa6408ea.
-2024-12-14 17:11:50,707 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea.gz.
-2024-12-14 17:11:50,707 - INFO - assuming fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea.gz is an FCIDUMP file.
-2024-12-14 17:11:50,707 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea.gz...
-2024-12-14 17:11:50,712 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:11:51,369 - INFO - Authentication (publickey) successful!
-2024-12-14 17:11:51,387 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:11:51,468 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:11:51,486 - INFO - ===============================================
-2024-12-14 17:11:51,486 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:12:00,323 - INFO - Circuit initialization time: 8.83671 seconds.
-2024-12-14 17:12:00,323 - INFO - Estimating logical resources...
-2024-12-14 17:12:01,461 - INFO - Resource estimation time (seconds): 1.137834
-2024-12-14 17:12:01,463 - INFO - parsing ../problem_instances/problem_instance.ru_mono.7213642b-5f16-48be-d5e5-2bc42ebb8526.json
-2024-12-14 17:12:01,463 - INFO - problem_instance UUID: 7213642b-5f16-48be-d5e5-2bc42ebb8526
-2024-12-14 17:12:01,463 - INFO - problem_instance short name: ru_mono
-2024-12-14 17:12:01,463 - INFO - contains 6 associated Hamiltonians.
-2024-12-14 17:12:01,478 - INFO - Analyzing task 5509795a-90ce-45d6-b03d-db956a5da5b2...
-2024-12-14 17:12:01,478 - INFO - number of supporting files: 1
-2024-12-14 17:12:01,478 - INFO - supporting data file UUID: cb60079d-5a30-4e3a-89d5-dbe95822df5e.
-2024-12-14 17:12:01,479 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e.gz.
-2024-12-14 17:12:01,479 - INFO - assuming fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e.gz is an FCIDUMP file.
-2024-12-14 17:12:01,479 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e.gz...
-2024-12-14 17:12:01,484 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:02,140 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:02,155 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:02,214 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:02,219 - INFO - ===============================================
-2024-12-14 17:12:02,219 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:12:05,424 - INFO - Circuit initialization time: 3.204817 seconds.
-2024-12-14 17:12:05,424 - INFO - Estimating logical resources...
-2024-12-14 17:12:06,612 - INFO - Resource estimation time (seconds): 1.188307
-2024-12-14 17:12:06,613 - INFO - Analyzing task bc3520b5-bf25-4a43-892c-8d7e9a690fe2...
-2024-12-14 17:12:06,613 - INFO - number of supporting files: 1
-2024-12-14 17:12:06,613 - INFO - supporting data file UUID: 4811297e-a8df-4150-9d4d-376fd0c6e9cd.
-2024-12-14 17:12:06,613 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd.gz.
-2024-12-14 17:12:06,613 - INFO - assuming fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd.gz is an FCIDUMP file.
-2024-12-14 17:12:06,613 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd.gz...
-2024-12-14 17:12:06,619 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:07,258 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:07,275 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:07,389 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:07,992 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 17:12:07,992 - INFO - Analyzing task d937e005-3688-4138-9465-426798087395...
-2024-12-14 17:12:07,992 - INFO - number of supporting files: 1
-2024-12-14 17:12:07,992 - INFO - supporting data file UUID: 30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.
-2024-12-14 17:12:07,993 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.gz.
-2024-12-14 17:12:07,993 - INFO - assuming fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.gz is an FCIDUMP file.
-2024-12-14 17:12:07,993 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.gz...
-2024-12-14 17:12:07,998 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:08,648 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:08,666 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:08,722 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:08,734 - INFO - ===============================================
-2024-12-14 17:12:08,734 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:12:12,147 - INFO - Circuit initialization time: 3.413223 seconds.
-2024-12-14 17:12:12,147 - INFO - Estimating logical resources...
-2024-12-14 17:12:13,020 - INFO - Resource estimation time (seconds): 0.872327
-2024-12-14 17:12:13,020 - INFO - Analyzing task ace55695-1ca9-4153-8fd4-55ed6658cf8c...
-2024-12-14 17:12:13,020 - INFO - number of supporting files: 1
-2024-12-14 17:12:13,020 - INFO - supporting data file UUID: a2417602-4e97-4395-b3f0-1e29262c8053.
-2024-12-14 17:12:13,020 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053.gz.
-2024-12-14 17:12:13,020 - INFO - assuming fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053.gz is an FCIDUMP file.
-2024-12-14 17:12:13,020 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053.gz...
-2024-12-14 17:12:13,025 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:13,671 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:13,687 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:13,825 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:14,581 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 17:12:14,581 - INFO - Analyzing task dab492c3-27fe-4ac3-8c98-de2563caf66c...
-2024-12-14 17:12:14,581 - INFO - number of supporting files: 1
-2024-12-14 17:12:14,581 - INFO - supporting data file UUID: 51f7d629-9a0e-4688-8562-59a5f0c0a404.
-2024-12-14 17:12:14,581 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404.gz.
-2024-12-14 17:12:14,581 - INFO - assuming fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404.gz is an FCIDUMP file.
-2024-12-14 17:12:14,581 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404.gz...
-2024-12-14 17:12:14,586 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:15,231 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:15,246 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:15,300 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:15,304 - INFO - ===============================================
-2024-12-14 17:12:15,305 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:12:18,439 - INFO - Circuit initialization time: 3.133947 seconds.
-2024-12-14 17:12:18,439 - INFO - Estimating logical resources...
-2024-12-14 17:12:19,421 - INFO - Resource estimation time (seconds): 0.981753
-2024-12-14 17:12:19,421 - INFO - Analyzing task a475af8e-cb0b-4533-906d-a6b8eda313e7...
-2024-12-14 17:12:19,421 - INFO - number of supporting files: 1
-2024-12-14 17:12:19,421 - INFO - supporting data file UUID: 7be1766a-b3f7-4779-9a69-f4358645831b.
-2024-12-14 17:12:19,421 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b.gz.
-2024-12-14 17:12:19,421 - INFO - assuming fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b.gz is an FCIDUMP file.
-2024-12-14 17:12:19,421 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b.gz...
-2024-12-14 17:12:19,426 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:20,090 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:20,107 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:20,214 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:20,618 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 17:12:20,619 - INFO - parsing ../problem_instances/problem_instance.mo2_n2.90d4e4fc-1216-4846-b45f-198c0530e29b.json
-2024-12-14 17:12:20,619 - INFO - problem_instance UUID: 90d4e4fc-1216-4846-b45f-198c0530e29b
-2024-12-14 17:12:20,619 - INFO - problem_instance short name: mo2_n2
-2024-12-14 17:12:20,620 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 17:12:20,630 - INFO - Analyzing task e3a07092-d1e5-4867-a4d7-d0258f9df6db...
-2024-12-14 17:12:20,630 - INFO - number of supporting files: 1
-2024-12-14 17:12:20,630 - INFO - supporting data file UUID: 09c3ddd5-0187-46e8-95c3-157c470cb69a.
-2024-12-14 17:12:20,630 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a.gz.
-2024-12-14 17:12:20,630 - INFO - assuming fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a.gz is an FCIDUMP file.
-2024-12-14 17:12:20,630 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a.gz...
-2024-12-14 17:12:20,635 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:21,276 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:21,289 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:25,153 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:35,065 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 17:12:35,066 - INFO - Analyzing task 138733f0-08f5-4077-b848-813c8ec53c79...
-2024-12-14 17:12:35,066 - INFO - number of supporting files: 1
-2024-12-14 17:12:35,066 - INFO - supporting data file UUID: f36a9dbc-c34a-401f-8ea6-dc996d785edf.
-2024-12-14 17:12:35,066 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf.gz.
-2024-12-14 17:12:35,066 - INFO - assuming fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf.gz is an FCIDUMP file.
-2024-12-14 17:12:35,066 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf.gz...
-2024-12-14 17:12:35,076 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:35,744 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:35,788 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:40,594 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:48,125 - INFO - Skipping Logical Resource Estimate because number of orbitals (70) exceeds maximum specified in config (32).
-2024-12-14 17:12:48,126 - INFO - Analyzing task 79b74ad4-afa8-458f-87a3-a5ec339056c6...
-2024-12-14 17:12:48,126 - INFO - number of supporting files: 1
-2024-12-14 17:12:48,126 - INFO - supporting data file UUID: 9cba211b-820c-4ad4-a050-336e8049e1c7.
-2024-12-14 17:12:48,126 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7.gz.
-2024-12-14 17:12:48,126 - INFO - assuming fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7.gz is an FCIDUMP file.
-2024-12-14 17:12:48,126 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7.gz...
-2024-12-14 17:12:48,131 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:48,773 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:48,789 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:52,626 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:02,349 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 17:13:02,350 - INFO - parsing ../problem_instances/problem_instance.MnO_0.e2212cdf-adef-454a-b218-05041d723c55.json
-2024-12-14 17:13:02,350 - INFO - problem_instance UUID: e2212cdf-adef-454a-b218-05041d723c55
-2024-12-14 17:13:02,351 - INFO - problem_instance short name: MnO_0
-2024-12-14 17:13:02,351 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:13:02,366 - INFO - Analyzing task f0ee8150-86e2-4f9e-ae35-95af38f3c69e...
-2024-12-14 17:13:02,366 - INFO - number of supporting files: 2
-2024-12-14 17:13:02,366 - INFO - supporting data file UUID: 55355f72-52f0-427d-b5ac-3b41666ca5fb.
-2024-12-14 17:13:02,366 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb.gz.
-2024-12-14 17:13:02,366 - INFO - assuming fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb.gz is an FCIDUMP file.
-2024-12-14 17:13:02,366 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb.gz...
-2024-12-14 17:13:02,371 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:02,997 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:03,018 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:10,564 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:24,502 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 17:13:24,502 - INFO - supporting data file UUID: fcdc3853-9542-4586-a0bc-9ec19df6a63a.
-2024-12-14 17:13:24,502 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/MnO_vdz.fcdc3853-9542-4586-a0bc-9ec19df6a63a.chk.
-2024-12-14 17:13:24,503 - INFO - assuming MnO_vdz.fcdc3853-9542-4586-a0bc-9ec19df6a63a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:13:24,504 - INFO - parsing ../problem_instances/problem_instance.mo_n2_pincer.8a3787cc-d3d0-42a8-d9a9-7de2aed45208.json
-2024-12-14 17:13:24,505 - INFO - problem_instance UUID: 8a3787cc-d3d0-42a8-d9a9-7de2aed45208
-2024-12-14 17:13:24,505 - INFO - problem_instance short name: mo_n2_pincer
-2024-12-14 17:13:24,505 - INFO - contains 16 associated Hamiltonians.
-2024-12-14 17:13:24,520 - INFO - Analyzing task aaae8d93-cb88-41ee-8f11-c70cc9b0d7fb...
-2024-12-14 17:13:24,520 - INFO - number of supporting files: 1
-2024-12-14 17:13:24,520 - INFO - supporting data file UUID: 4476d0ff-9618-4774-9619-e3f223249cea.
-2024-12-14 17:13:24,520 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea.gz.
-2024-12-14 17:13:24,521 - INFO - assuming fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea.gz is an FCIDUMP file.
-2024-12-14 17:13:24,521 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea.gz...
-2024-12-14 17:13:24,526 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:25,176 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:25,192 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:25,845 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:29,770 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 17:13:29,770 - INFO - Analyzing task 5547bb48-fac6-4426-91ad-c4853ce421aa...
-2024-12-14 17:13:29,770 - INFO - number of supporting files: 1
-2024-12-14 17:13:29,770 - INFO - supporting data file UUID: d74d0c01-8507-445b-bec1-f02bafbbfaab.
-2024-12-14 17:13:29,770 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab.gz.
-2024-12-14 17:13:29,771 - INFO - assuming fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab.gz is an FCIDUMP file.
-2024-12-14 17:13:29,771 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab.gz...
-2024-12-14 17:13:29,783 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:30,430 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:30,445 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:34,465 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:44,782 - INFO - Skipping Logical Resource Estimate because number of orbitals (70) exceeds maximum specified in config (32).
-2024-12-14 17:13:44,783 - INFO - Analyzing task db75bf65-181b-40c2-b978-26453437c2b0...
-2024-12-14 17:13:44,783 - INFO - number of supporting files: 1
-2024-12-14 17:13:44,783 - INFO - supporting data file UUID: f6516937-6182-4dae-a39c-f94c0d72bf70.
-2024-12-14 17:13:44,783 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70.gz.
-2024-12-14 17:13:44,783 - INFO - assuming fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70.gz is an FCIDUMP file.
-2024-12-14 17:13:44,783 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70.gz...
-2024-12-14 17:13:44,787 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:45,417 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:45,431 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:46,000 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:50,163 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 17:13:50,163 - INFO - Analyzing task ab482d50-9a85-48d9-aa17-83dcbb38614b...
-2024-12-14 17:13:50,163 - INFO - number of supporting files: 1
-2024-12-14 17:13:50,163 - INFO - supporting data file UUID: 53abfc75-37a3-440c-a023-6e4cbffecd6a.
-2024-12-14 17:13:50,163 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a.gz.
-2024-12-14 17:13:50,163 - INFO - assuming fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a.gz is an FCIDUMP file.
-2024-12-14 17:13:50,163 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a.gz...
-2024-12-14 17:13:50,167 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:50,798 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:50,813 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:54,731 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:14:04,394 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 17:14:04,395 - INFO - Analyzing task b628f4be-582f-4f23-96eb-c8b9e0005e4a...
-2024-12-14 17:14:04,395 - INFO - number of supporting files: 1
-2024-12-14 17:14:04,395 - INFO - supporting data file UUID: 3527a125-6e74-4df9-a9ac-ebba7d8b84ff.
-2024-12-14 17:14:04,395 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff.gz.
-2024-12-14 17:14:04,395 - INFO - assuming fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff.gz is an FCIDUMP file.
-2024-12-14 17:14:04,395 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff.gz...
-2024-12-14 17:14:04,400 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:14:05,044 - INFO - Authentication (publickey) successful!
-2024-12-14 17:14:05,062 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:14:05,164 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:14:05,571 - INFO - ===============================================
-2024-12-14 17:14:05,571 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:18:25,391 - INFO - Circuit initialization time: 259.81912 seconds.
-2024-12-14 17:18:25,391 - INFO - Estimating logical resources...
-2024-12-14 17:18:56,509 - INFO - Resource estimation time (seconds): 31.118684
-2024-12-14 17:18:56,510 - INFO - Analyzing task c436c481-00d1-49ec-8d0e-0a5e83a8df19...
-2024-12-14 17:18:56,510 - INFO - number of supporting files: 1
-2024-12-14 17:18:56,510 - INFO - supporting data file UUID: 7fc6d81a-8e1c-436f-ade2-93aed1dfee42.
-2024-12-14 17:18:56,510 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42.gz.
-2024-12-14 17:18:56,510 - INFO - assuming fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42.gz is an FCIDUMP file.
-2024-12-14 17:18:56,510 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42.gz...
-2024-12-14 17:18:56,516 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:18:57,152 - INFO - Authentication (publickey) successful!
-2024-12-14 17:18:57,167 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:18:57,431 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:18:59,213 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:18:59,213 - INFO - Analyzing task 349e9cbe-d675-411f-b6b8-be846c27902c...
-2024-12-14 17:18:59,213 - INFO - number of supporting files: 1
-2024-12-14 17:18:59,213 - INFO - supporting data file UUID: 2e1dab84-5b1a-4521-8d36-78117ab88bbd.
-2024-12-14 17:18:59,213 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd.gz.
-2024-12-14 17:18:59,214 - INFO - assuming fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd.gz is an FCIDUMP file.
-2024-12-14 17:18:59,214 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd.gz...
-2024-12-14 17:18:59,218 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:18:59,845 - INFO - Authentication (publickey) successful!
-2024-12-14 17:18:59,860 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:19:00,621 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:19:04,584 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 17:19:04,584 - INFO - Analyzing task 3eccbccf-e84a-44b9-b775-cef772cd84f0...
-2024-12-14 17:19:04,585 - INFO - number of supporting files: 1
-2024-12-14 17:19:04,585 - INFO - supporting data file UUID: 21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.
-2024-12-14 17:19:04,585 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.gz.
-2024-12-14 17:19:04,585 - INFO - assuming fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.gz is an FCIDUMP file.
-2024-12-14 17:19:04,585 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.gz...
-2024-12-14 17:19:04,589 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:19:05,247 - INFO - Authentication (publickey) successful!
-2024-12-14 17:19:05,267 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:19:09,259 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:19:18,888 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 17:19:18,888 - INFO - Analyzing task 4c240146-6b8b-4fa5-88e4-41cbd39c8ac3...
-2024-12-14 17:19:18,888 - INFO - number of supporting files: 1
-2024-12-14 17:19:18,888 - INFO - supporting data file UUID: b96f67e6-fafe-4ccd-ac6f-67afb52f3835.
-2024-12-14 17:19:18,889 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835.gz.
-2024-12-14 17:19:18,889 - INFO - assuming fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835.gz is an FCIDUMP file.
-2024-12-14 17:19:18,889 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835.gz...
-2024-12-14 17:19:18,894 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:19:19,569 - INFO - Authentication (publickey) successful!
-2024-12-14 17:19:19,586 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:19:19,681 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:19:20,086 - INFO - ===============================================
-2024-12-14 17:19:20,086 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:23:50,686 - INFO - Circuit initialization time: 270.59992 seconds.
-2024-12-14 17:23:50,686 - INFO - Estimating logical resources...
-2024-12-14 17:24:29,159 - INFO - Resource estimation time (seconds): 38.472807
-2024-12-14 17:24:29,160 - INFO - Analyzing task c582e543-075c-4fa1-b189-5e7455286d82...
-2024-12-14 17:24:29,160 - INFO - number of supporting files: 1
-2024-12-14 17:24:29,160 - INFO - supporting data file UUID: 47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.
-2024-12-14 17:24:29,160 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.gz.
-2024-12-14 17:24:29,160 - INFO - assuming fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.gz is an FCIDUMP file.
-2024-12-14 17:24:29,160 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.gz...
-2024-12-14 17:24:29,164 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:24:29,790 - INFO - Authentication (publickey) successful!
-2024-12-14 17:24:29,807 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:24:30,007 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:24:31,804 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:24:31,805 - INFO - Analyzing task 3fa3940d-8a68-44ae-9223-7346404651e6...
-2024-12-14 17:24:31,805 - INFO - number of supporting files: 1
-2024-12-14 17:24:31,805 - INFO - supporting data file UUID: bed1771c-394c-44e6-93e3-ca41732326d2.
-2024-12-14 17:24:31,805 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2.gz.
-2024-12-14 17:24:31,805 - INFO - assuming fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2.gz is an FCIDUMP file.
-2024-12-14 17:24:31,805 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2.gz...
-2024-12-14 17:24:31,810 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:24:32,457 - INFO - Authentication (publickey) successful!
-2024-12-14 17:24:32,475 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:24:32,584 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:24:32,995 - INFO - ===============================================
-2024-12-14 17:24:32,995 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:28:55,405 - INFO - Circuit initialization time: 262.410027 seconds.
-2024-12-14 17:28:55,405 - INFO - Estimating logical resources...
-2024-12-14 17:29:32,271 - INFO - Resource estimation time (seconds): 36.865501
-2024-12-14 17:29:32,271 - INFO - Analyzing task eadd62e9-ee3d-4193-94de-7735a529edce...
-2024-12-14 17:29:32,271 - INFO - number of supporting files: 1
-2024-12-14 17:29:32,271 - INFO - supporting data file UUID: 98016425-092d-41a4-b397-9b4b237c582a.
-2024-12-14 17:29:32,271 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a.gz.
-2024-12-14 17:29:32,271 - INFO - assuming fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a.gz is an FCIDUMP file.
-2024-12-14 17:29:32,271 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a.gz...
-2024-12-14 17:29:32,276 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:29:32,958 - INFO - Authentication (publickey) successful!
-2024-12-14 17:29:32,975 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:29:33,560 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:29:35,359 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:29:35,360 - INFO - Analyzing task b900c4a3-fe87-4df7-96b7-2767ccdc1d56...
-2024-12-14 17:29:35,360 - INFO - number of supporting files: 1
-2024-12-14 17:29:35,360 - INFO - supporting data file UUID: e03635b0-a537-4a58-9f3e-c7114715e47d.
-2024-12-14 17:29:35,360 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d.gz.
-2024-12-14 17:29:35,360 - INFO - assuming fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d.gz is an FCIDUMP file.
-2024-12-14 17:29:35,360 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d.gz...
-2024-12-14 17:29:35,365 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:29:36,015 - INFO - Authentication (publickey) successful!
-2024-12-14 17:29:36,220 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:29:36,314 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:29:36,736 - INFO - ===============================================
-2024-12-14 17:29:36,736 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:33:57,278 - INFO - Circuit initialization time: 260.542279 seconds.
-2024-12-14 17:33:57,279 - INFO - Estimating logical resources...
-2024-12-14 17:34:35,671 - INFO - Resource estimation time (seconds): 38.392327
-2024-12-14 17:34:35,671 - INFO - Analyzing task 7fc4c1d7-3469-40a3-9cd8-4354b6acf01d...
-2024-12-14 17:34:35,671 - INFO - number of supporting files: 1
-2024-12-14 17:34:35,671 - INFO - supporting data file UUID: f7797f63-30ab-40e0-8ca6-042c9aa932b4.
-2024-12-14 17:34:35,671 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4.gz.
-2024-12-14 17:34:35,671 - INFO - assuming fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4.gz is an FCIDUMP file.
-2024-12-14 17:34:35,671 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4.gz...
-2024-12-14 17:34:35,678 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:34:36,334 - INFO - Authentication (publickey) successful!
-2024-12-14 17:34:36,349 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:34:36,619 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:34:38,408 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:34:38,409 - INFO - Analyzing task 09b81c3d-aee1-4bc3-98ce-a72da477b108...
-2024-12-14 17:34:38,409 - INFO - number of supporting files: 1
-2024-12-14 17:34:38,409 - INFO - supporting data file UUID: e701d53e-63fe-47f1-b727-39457c9207e6.
-2024-12-14 17:34:38,409 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6.gz.
-2024-12-14 17:34:38,409 - INFO - assuming fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6.gz is an FCIDUMP file.
-2024-12-14 17:34:38,409 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6.gz...
-2024-12-14 17:34:38,414 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:34:39,051 - INFO - Authentication (publickey) successful!
-2024-12-14 17:34:39,068 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:34:39,143 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:34:39,253 - INFO - ===============================================
-2024-12-14 17:34:39,253 - INFO - Calculating Logical Resource Estimate...
-2024-12-14 17:36:30,409 - INFO - Circuit initialization time: 111.156025 seconds.
-2024-12-14 17:36:30,409 - INFO - Estimating logical resources...
-2024-12-14 17:36:49,078 - INFO - Resource estimation time (seconds): 18.668672
-2024-12-14 17:36:49,078 - INFO - Analyzing task 87d59f7c-e397-42dc-aa6e-00200d8697aa...
-2024-12-14 17:36:49,078 - INFO - number of supporting files: 1
-2024-12-14 17:36:49,078 - INFO - supporting data file UUID: 21abd0b3-b2cb-4a8a-812e-a8706542f429.
-2024-12-14 17:36:49,079 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429.gz.
-2024-12-14 17:36:49,079 - INFO - assuming fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429.gz is an FCIDUMP file.
-2024-12-14 17:36:49,079 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429.gz...
-2024-12-14 17:36:49,085 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:36:49,723 - INFO - Authentication (publickey) successful!
-2024-12-14 17:36:49,739 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:36:49,861 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:36:50,872 - INFO - Skipping Logical Resource Estimate because number of orbitals (39) exceeds maximum specified in config (32).
-2024-12-14 17:36:50,875 - INFO - parsing ../problem_instances/problem_instance.c_o2_0.3987b2dd-25bc-44e2-b516-dbc3f670a9c3.json
-2024-12-14 17:36:50,875 - INFO - problem_instance UUID: 3987b2dd-25bc-44e2-b516-dbc3f670a9c3
-2024-12-14 17:36:50,875 - INFO - problem_instance short name: c_o2_0
-2024-12-14 17:36:50,875 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 17:36:50,890 - INFO - Analyzing task 615c9d78-2b84-4c7b-ab6b-ba05b188f50a...
-2024-12-14 17:36:50,890 - INFO - number of supporting files: 2
-2024-12-14 17:36:50,890 - INFO - supporting data file UUID: b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.
-2024-12-14 17:36:50,891 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.gz.
-2024-12-14 17:36:50,891 - INFO - assuming fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.gz is an FCIDUMP file.
-2024-12-14 17:36:50,891 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.gz...
-2024-12-14 17:36:50,896 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:36:51,554 - INFO - Authentication (publickey) successful!
-2024-12-14 17:36:51,567 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:36:51,705 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:36:52,857 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 17:36:52,857 - INFO - supporting data file UUID: 6220544f-c707-41a9-ad9a-40ff8ecd9806.
-2024-12-14 17:36:52,857 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o2_cc-pVDZ.6220544f-c707-41a9-ad9a-40ff8ecd9806.chk.
-2024-12-14 17:36:52,857 - INFO - assuming c_o2_cc-pVDZ.6220544f-c707-41a9-ad9a-40ff8ecd9806.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:36:52,857 - INFO - Analyzing task a091c1a1-bde2-4a83-bf58-5010f7a8e1d4...
-2024-12-14 17:36:52,857 - INFO - number of supporting files: 2
-2024-12-14 17:36:52,857 - INFO - supporting data file UUID: 0ffd2489-0b50-49b6-9e6e-7607f14102a9.
-2024-12-14 17:36:52,858 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9.gz.
-2024-12-14 17:36:52,858 - INFO - assuming fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9.gz is an FCIDUMP file.
-2024-12-14 17:36:52,858 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9.gz...
-2024-12-14 17:36:52,863 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:36:53,507 - INFO - Authentication (publickey) successful!
-2024-12-14 17:36:53,523 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:37:06,585 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:37:24,227 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 17:37:24,227 - INFO - supporting data file UUID: b7c6b59b-435b-47e0-8f7b-d2e3b5573437.
-2024-12-14 17:37:24,228 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o2_cc-pVTZ.b7c6b59b-435b-47e0-8f7b-d2e3b5573437.chk.
-2024-12-14 17:37:24,228 - INFO - assuming c_o2_cc-pVTZ.b7c6b59b-435b-47e0-8f7b-d2e3b5573437.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:37:24,232 - INFO - done.
-2024-12-14 17:37:24,232 - INFO - overall start time: 2024-12-14 13:38:56.164564
-2024-12-14 17:37:24,232 - INFO - overall stop time: 2024-12-14 17:37:24.232529
-2024-12-14 17:37:24,232 - INFO - run time (seconds): 14308.067965
+  
+2024-12-17 08:17:17,609 - INFO - ===============================================
+2024-12-17 08:17:17,610 - INFO - overall start time: 2024-12-17 08:17:17.609939
+2024-12-17 08:17:17,610 - INFO - input directory: ./testing_LRE/problem_instances/
+2024-12-17 08:17:17,610 - INFO - parsing 1 files in the input directory
+2024-12-17 08:17:17,610 - INFO - file: problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
+2024-12-17 08:17:17,611 - INFO - parsing 0 files in the output directory
+2024-12-17 08:17:17,611 - INFO - found 0 existing solutions for this solver.
+2024-12-17 08:17:17,611 - INFO - parsing ./testing_LRE/problem_instances/problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
+2024-12-17 08:17:17,611 - INFO - problem_instance UUID: c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7
+2024-12-17 08:17:17,611 - INFO - problem_instance short name: Sc_1
+2024-12-17 08:17:17,612 - INFO - contains 3 associated Hamiltonians.
+2024-12-17 08:17:17,628 - INFO - Analyzing task ca6f7678-0952-4fe4-83fe-c4455a682132...
+2024-12-17 08:17:17,628 - INFO - number of supporting files: 2
+2024-12-17 08:17:17,628 - INFO - supporting data file UUID: 75228927-fac3-4caf-9e09-1fdfe51098a3.
+2024-12-17 08:17:17,628 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz.
+2024-12-17 08:17:17,629 - INFO - assuming fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz is an FCIDUMP file.
+2024-12-17 08:17:17,629 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz...
+2024-12-17 08:17:17,636 - INFO - Connected (version 2.0, client 0)
+2024-12-17 08:17:18,278 - INFO - Authentication (publickey) successful!
+2024-12-17 08:17:18,291 - INFO - [chan 0] Opened sftp connection (server version 3)
+2024-12-17 08:17:18,486 - INFO - [chan 0] sftp session closed.
+2024-12-17 08:17:20,358 - INFO - ===============================================
+2024-12-17 08:17:20,358 - INFO - Calculating Logical Resource Estimate...
+2024-12-17 08:39:05,694 - INFO - Circuit initialization time: 1305.335335 seconds.
+2024-12-17 08:39:05,694 - INFO - Estimating logical resources...
+2024-12-17 08:47:34,506 - INFO - Resource estimation time (seconds): 508.811682
+2024-12-17 08:47:34,506 - INFO - supporting data file UUID: 5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.
+2024-12-17 08:47:34,506 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk.
+2024-12-17 08:47:34,506 - INFO - assuming Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk is NOT an FCIDUMP file.  SKIPPING!
+2024-12-17 08:47:34,506 - INFO - Analyzing task 10119019-eea2-45c9-a748-e206780c4235...
+2024-12-17 08:47:34,506 - INFO - number of supporting files: 2
+2024-12-17 08:47:34,507 - INFO - supporting data file UUID: cfc29172-5c9c-4e13-9a31-17895ed89c95.
+2024-12-17 08:47:34,507 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz.
+2024-12-17 08:47:34,507 - INFO - assuming fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz is an FCIDUMP file.
+2024-12-17 08:47:34,507 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz...
+2024-12-17 08:47:34,512 - INFO - Connected (version 2.0, client 0)
+2024-12-17 08:47:34,991 - INFO - Authentication (publickey) successful!
+2024-12-17 08:47:35,006 - INFO - [chan 0] Opened sftp connection (server version 3)
+2024-12-17 08:49:59,649 - INFO - [chan 0] sftp session closed.
+2024-12-17 08:51:04,187 - INFO - ===============================================
+2024-12-17 08:51:04,187 - INFO - Calculating Logical Resource Estimate...
diff --git a/scripts/nohup.out b/scripts/nohup.out
deleted file mode 100644
index e558048..0000000
--- a/scripts/nohup.out
+++ /dev/null
@@ -1,8965 +0,0 @@
-2024-12-13 23:10:56,630 - INFO - ===============================================
-2024-12-13 23:10:56,630 - INFO - overall start time: 2024-12-13 23:10:56.630159
-2024-12-13 23:10:56,630 - INFO - input directory: ../problem_instances/
-2024-12-13 23:10:56,630 - INFO - parsing 82 files in the input directory
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.cl2_0.0e393c20-3915-42b9-a8aa-29bf53548269.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.Cu_0.1448d27d-bfa9-470f-a6c8-864a295b66f4.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.si2_h6_0.0c1dfb55-f021-409a-80b1-79c8c2908095.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.blue_dimer.dc8bdc56-5ebd-4996-6b81-81b1a06d8c76.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.benzene.f377cc27-366a-45af-b45a-c8478e4b6199.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.Cr_1.02a8c4e9-9d15-4742-b4cc-7f47f69da0e5.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.Ti_1.9823b0dd-87b6-4793-9741-e8cbcf2b50c0.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.V_0.a14a1e28-71c5-4e23-bf6e-dd9662a6df58.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.CuO_0.886ad5bf-d487-48c8-b08c-c9f82b84ed5d.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.TiO_0.0b91f99e-8de5-415d-a78e-f80e45d621ca.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.na2_0.edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.mn_mono.cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.FeO_0.55d0ed82-0560-4448-8459-c2ba00654d9d.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.p_h3_0.0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57.json
-2024-12-13 23:10:56,630 - INFO - file: problem_instance.h2_s_0.208f2e50-2b56-4e72-815a-cba5cec1264c.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Sc_0.67f72316-2262-44fb-8c0a-e159e1cd0cf0.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.na_cl_0.3f141f05-532b-478d-b38a-2ae07baadc88.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.c2_h2_0.0ca102a7-dad4-4d42-8c73-9acfa45378d7.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.li_f_0.e48e7467-1fcd-478b-a599-f4ce881c57b9.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.h2_c_o_0.25fd617b-8e7f-4422-9e97-cc3f6b0d3876.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0011.766ba2da-e72a-4e03-a739-f97269026fc4.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Mn_0.bc202949-d76c-4962-b937-5c12b298b8b4.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0008.b57eb979-5c09-4974-97b4-5862e109a1ae.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.mo_n2.664ec8e4-09d5-41cc-6266-ddb26219366f.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.li_h_0.6d355019-13aa-41fc-a530-31d5f968ba22.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.li2_0.3301a356-21a9-472b-8021-f02f4d2c9eec.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.h_f_0.892e3341-7186-44c6-9a1a-20f270ddc8b8.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Fe_0.05abb33d-ecea-406f-8832-31a814b26dfd.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0010.bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.ru_macho.b78a10f2-ce8a-43c0-69ec-4cf666d8e85c.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Cu_1.d5c7ab73-dfc1-499e-9027-601476004107.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.n_h3_0.127cfea5-8a7d-45a0-9012-949816a0b8d9.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0006.42958a3e-8b35-4992-acd8-6711848066c1.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.n2_h4_0.f1a6b508-75e8-4afb-9c81-fc61af11b523.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.c2_h4_0.9fbd9b4c-5ea9-4095-af7b-7d4491399e42.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.O_1.d712afaf-6ec4-42d9-b5fd-1edee3ec1046.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.cr_dimer.8ed1a800-a4c6-4bff-a6de-cb220554c42f.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.be_0.19cada59-64cc-466c-8809-782a4f574dcc.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.f2_0.e3e78b41-577d-4536-a63f-7e968eeb6493.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.n2_0.9bd9cde6-6daa-441a-984e-ae1c1c051e91.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.fe_red.a8895776-3583-4884-fbc7-d6f9df21a7ac.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Fe_1.33c9a058-7a67-454c-856c-2519ba55b44d.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.ScO_0.7437abf0-1394-47ce-9218-d181f1732112.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0003.a37c86c0-1937-4f05-83ab-08a5fd104b7e.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.h_c_n_0.8846a90e-96cb-4bc3-ad06-5388212f728e.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.si_h4_0.13c7144d-047e-4431-8d02-0b1d14c0526b.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.planted_solution_0009.8db449b1-265b-4a66-b965-a2b4833a88d1.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.Mn_1.11c8be98-d9c9-40ea-8d88-ea8c555028f6.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.c_h3_cl_0.379781b8-5732-492e-9fca-6fad3fc3692a.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.p2_0.2e61ba35-b6b0-42b5-b3e8-d25bd83145ba.json
-2024-12-13 23:10:56,631 - INFO - file: problem_instance.si_o_0.68f1a091-8652-4095-ba31-56f0e02e27d3.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h2_o_0.9b8083ab-ea59-47db-894c-95a0d2ba3cb6.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h_o_cl_0.ea2e13c5-6d80-466e-bd6b-6289e10ed82b.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c2_h6_0.b1c5ac4e-9b94-4e89-9557-da2026933172.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0001.3d3b9e8a-7842-4ca1-bd82-eddb9804972d.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_h4_0.e0f6ed02-6502-454b-bf2c-e7994e0510f4.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.V_1.18e1973e-d6cf-48d6-9ca4-c1af21ff7c98.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0007.3aaf0bb4-b412-4746-922a-c380b4024d00.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.Ti_0.c1e4c7dd-2dc4-4dd0-889d-fb34f602965a.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.CrO_0.2140edd4-8eb3-4270-b753-278334998e3d.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0002.00043d56-ed63-4266-907c-99c95c51b9db.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h3_c_o_h_0.5524b5e5-adba-4322-9808-69e75e4335b2.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.Cr_0.b8fe08a4-82fe-4636-9812-b1e0666f95b5.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h2_o2_0.cc7044d7-28e0-4fe2-bd6b-c9c758da4776.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_o_0.1c3155e0-3679-4eff-bed0-57a1082672c3.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.si_h2_singlet_0.a0a07bfe-aac2-4d61-9425-009953899b3b.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_s_0.f90280cc-c860-4ff1-a9ec-4841cec989f7.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h3_c_s_h_0.674b572a-3d6d-4418-8cc2-4755d90367ee.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.h_cl_0.586ce6a9-1876-459e-9b6c-be8bb1c4d1a5.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.s_o2_0.1d0b8322-24b3-407a-8246-07444bb020be.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0004.e0adafc5-789e-43e6-8f9e-e718da28de3a.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.O_0.162f41da-af43-427c-a8bc-ae9fa97ace95.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.ozone.9560107e-f1ad-4480-aa51-ef03edda6e19.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_h2_singlet_0.7ca1486c-06a5-47c1-b8ab-eab491ffc68b.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.VO_0.bcc86483-2a7e-4271-b6fc-238ef5e682f6.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.planted_solution_0005.7e0fb928-b0a9-4b44-89f1-7e0ee3b2bb13.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.ru_mono.7213642b-5f16-48be-d5e5-2bc42ebb8526.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.mo2_n2.90d4e4fc-1216-4846-b45f-198c0530e29b.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.MnO_0.e2212cdf-adef-454a-b218-05041d723c55.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.mo_n2_pincer.8a3787cc-d3d0-42a8-d9a9-7de2aed45208.json
-2024-12-13 23:10:56,632 - INFO - file: problem_instance.c_o2_0.3987b2dd-25bc-44e2-b516-dbc3f670a9c3.json
-2024-12-13 23:10:56,632 - INFO - parsing ../problem_instances/problem_instance.cl2_0.0e393c20-3915-42b9-a8aa-29bf53548269.json
-2024-12-13 23:10:56,633 - INFO - problem_instance UUID: 0e393c20-3915-42b9-a8aa-29bf53548269
-2024-12-13 23:10:56,633 - INFO - problem_instance short name: cl2_0
-2024-12-13 23:10:56,633 - INFO - contains 3 associated Hamiltonians.
-2024-12-13 23:10:56,667 - INFO - Analyzing task c01649e2-8c5c-4827-a037-1ede2159e558...
-2024-12-13 23:10:56,668 - INFO - number of supporting files: 2
-2024-12-13 23:10:56,668 - INFO - supporting data file UUID: 8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.
-2024-12-13 23:10:56,668 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz.
-2024-12-13 23:10:56,668 - INFO - assuming fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz is an FCIDUMP file.
-2024-12-13 23:10:56,668 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz...
-2024-12-13 23:10:56,674 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:10:57,255 - INFO - Authentication (publickey) successful!
-2024-12-13 23:10:57,269 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:10:57,417 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:10:58,066 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:10:58,066 - INFO - supporting data file UUID: 5277b7f4-854c-45a4-a98e-95db9b40c071.
-2024-12-13 23:10:58,066 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVDZ.5277b7f4-854c-45a4-a98e-95db9b40c071.chk.
-2024-12-13 23:10:58,066 - INFO - assuming cl2_cc-pVDZ.5277b7f4-854c-45a4-a98e-95db9b40c071.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:10:58,066 - INFO - Analyzing task 214bb702-d7bc-4141-8cf3-f6979ba0f67a...
-2024-12-13 23:10:58,066 - INFO - number of supporting files: 2
-2024-12-13 23:10:58,066 - INFO - supporting data file UUID: 7b8c2dbd-8966-4eb4-83af-8acb07454e8a.
-2024-12-13 23:10:58,066 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz.
-2024-12-13 23:10:58,066 - INFO - assuming fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz is an FCIDUMP file.
-2024-12-13 23:10:58,066 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz...
-2024-12-13 23:10:58,070 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:10:58,600 - INFO - Authentication (publickey) successful!
-2024-12-13 23:10:58,614 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:14:20,900 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:15:23,485 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-13 23:15:23,485 - INFO - supporting data file UUID: dba5899f-164d-4e94-85f7-a1d8757179ab.
-2024-12-13 23:15:23,485 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVQZ.dba5899f-164d-4e94-85f7-a1d8757179ab.chk.
-2024-12-13 23:15:23,485 - INFO - assuming cl2_cc-pVQZ.dba5899f-164d-4e94-85f7-a1d8757179ab.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:15:23,485 - INFO - Analyzing task 35e4c771-0f4f-4413-b42f-132f1e606cb0...
-2024-12-13 23:15:23,485 - INFO - number of supporting files: 2
-2024-12-13 23:15:23,485 - INFO - supporting data file UUID: 781d0704-7a95-4183-9c50-cbdbd976884a.
-2024-12-13 23:15:23,485 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz.
-2024-12-13 23:15:23,486 - INFO - assuming fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz is an FCIDUMP file.
-2024-12-13 23:15:23,486 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz...
-2024-12-13 23:15:23,491 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:15:23,998 - INFO - Authentication (publickey) successful!
-2024-12-13 23:15:24,011 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:15:27,388 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:15:35,743 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-13 23:15:35,743 - INFO - supporting data file UUID: 27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.
-2024-12-13 23:15:35,743 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVTZ.27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.chk.
-2024-12-13 23:15:35,743 - INFO - assuming cl2_cc-pVTZ.27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:15:35,750 - INFO - parsing ../problem_instances/problem_instance.Cu_0.1448d27d-bfa9-470f-a6c8-864a295b66f4.json
-2024-12-13 23:15:35,750 - INFO - problem_instance UUID: 1448d27d-bfa9-470f-a6c8-864a295b66f4
-2024-12-13 23:15:35,750 - INFO - problem_instance short name: Cu_0
-2024-12-13 23:15:35,751 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:15:35,762 - INFO - Analyzing task 7f0518e8-e2c8-4912-8268-4de4cd504084...
-2024-12-13 23:15:35,762 - INFO - number of supporting files: 2
-2024-12-13 23:15:35,763 - INFO - supporting data file UUID: 48434e2f-f09e-474e-b98c-af180386a258.
-2024-12-13 23:15:35,763 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz.
-2024-12-13 23:15:35,763 - INFO - assuming fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz is an FCIDUMP file.
-2024-12-13 23:15:35,763 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz...
-2024-12-13 23:15:35,768 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:15:36,272 - INFO - Authentication (publickey) successful!
-2024-12-13 23:15:36,285 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:15:36,918 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:15:40,311 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-13 23:15:40,311 - INFO - supporting data file UUID: 08885387-3319-4489-9487-56a333abf06b.
-2024-12-13 23:15:40,311 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu0_vdz.08885387-3319-4489-9487-56a333abf06b.chk.
-2024-12-13 23:15:40,311 - INFO - assuming Cu0_vdz.08885387-3319-4489-9487-56a333abf06b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:15:40,311 - INFO - Analyzing task 0f5171c4-cf55-4a82-99a2-c72edebce9c9...
-2024-12-13 23:15:40,311 - INFO - number of supporting files: 2
-2024-12-13 23:15:40,311 - INFO - supporting data file UUID: e304b6b5-b820-470d-a8b5-92d6354abd16.
-2024-12-13 23:15:40,311 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz.
-2024-12-13 23:15:40,311 - INFO - assuming fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz is an FCIDUMP file.
-2024-12-13 23:15:40,311 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz...
-2024-12-13 23:15:40,318 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:15:40,977 - INFO - Authentication (publickey) successful!
-2024-12-13 23:15:40,992 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:16:02,852 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:16:25,091 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-13 23:16:25,091 - INFO - supporting data file UUID: 34a02644-d0a3-4e3b-987c-c7962587f41a.
-2024-12-13 23:16:25,091 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu0_vtz.34a02644-d0a3-4e3b-987c-c7962587f41a.chk.
-2024-12-13 23:16:25,091 - INFO - assuming Cu0_vtz.34a02644-d0a3-4e3b-987c-c7962587f41a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:16:25,095 - INFO - parsing ../problem_instances/problem_instance.si2_h6_0.0c1dfb55-f021-409a-80b1-79c8c2908095.json
-2024-12-13 23:16:25,096 - INFO - problem_instance UUID: 0c1dfb55-f021-409a-80b1-79c8c2908095
-2024-12-13 23:16:25,096 - INFO - problem_instance short name: si2_h6_0
-2024-12-13 23:16:25,096 - INFO - contains 1 associated Hamiltonians.
-2024-12-13 23:16:25,111 - INFO - Analyzing task 109f95c5-8561-458c-8f41-72be596b87e6...
-2024-12-13 23:16:25,111 - INFO - number of supporting files: 2
-2024-12-13 23:16:25,111 - INFO - supporting data file UUID: bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.
-2024-12-13 23:16:25,111 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz.
-2024-12-13 23:16:25,111 - INFO - assuming fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz is an FCIDUMP file.
-2024-12-13 23:16:25,111 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz...
-2024-12-13 23:16:25,117 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:16:25,655 - INFO - Authentication (publickey) successful!
-2024-12-13 23:16:25,674 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:16:33,151 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:16:44,715 - INFO - Skipping Logical Resource Estimate because number of orbitals (66) exceeds maximum specified in config (32).
-2024-12-13 23:16:44,716 - INFO - supporting data file UUID: 6494dcb3-de3a-4bd2-bd92-a121241b95aa.
-2024-12-13 23:16:44,716 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si2_h6_cc-pVDZ.6494dcb3-de3a-4bd2-bd92-a121241b95aa.chk.
-2024-12-13 23:16:44,716 - INFO - assuming si2_h6_cc-pVDZ.6494dcb3-de3a-4bd2-bd92-a121241b95aa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:16:44,717 - INFO - parsing ../problem_instances/problem_instance.blue_dimer.dc8bdc56-5ebd-4996-6b81-81b1a06d8c76.json
-2024-12-13 23:16:44,718 - INFO - problem_instance UUID: dc8bdc56-5ebd-4996-6b81-81b1a06d8c76
-2024-12-13 23:16:44,718 - INFO - problem_instance short name: blue_dimer
-2024-12-13 23:16:44,718 - INFO - contains 12 associated Hamiltonians.
-2024-12-13 23:16:44,730 - INFO - Analyzing task 9da97ef6-4bad-4c82-8576-9b8e539a7ba8...
-2024-12-13 23:16:44,730 - INFO - number of supporting files: 1
-2024-12-13 23:16:44,731 - INFO - supporting data file UUID: 46967cfc-d867-40e8-bef0-9655c46cef29.
-2024-12-13 23:16:44,731 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz.
-2024-12-13 23:16:44,731 - INFO - assuming fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz is an FCIDUMP file.
-2024-12-13 23:16:44,731 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz...
-2024-12-13 23:16:44,739 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:16:45,247 - INFO - Authentication (publickey) successful!
-2024-12-13 23:16:45,276 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:16:45,638 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:16:45,678 - INFO - ===============================================
-2024-12-13 23:16:45,678 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:18:10,667 - INFO - Circuit initialization time: 84.989086 seconds.
-2024-12-13 23:18:10,667 - INFO - Estimating logical resources...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/cotengra/hyperoptimizers/hyper.py:33: UserWarning: Couldn't import `kahypar` - skipping from default hyper optimizer and using basic `labels` method instead.
-  warnings.warn(
-2024-12-13 23:18:20,529 - INFO - Resource estimation time (seconds): 9.861621
-2024-12-13 23:18:20,529 - INFO - Analyzing task f20db1b1-86e3-4ddf-96ff-a6d37f331935...
-2024-12-13 23:18:20,529 - INFO - number of supporting files: 1
-2024-12-13 23:18:20,529 - INFO - supporting data file UUID: 85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.
-2024-12-13 23:18:20,529 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz.
-2024-12-13 23:18:20,529 - INFO - assuming fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz is an FCIDUMP file.
-2024-12-13 23:18:20,529 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz...
-2024-12-13 23:18:20,534 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:18:21,053 - INFO - Authentication (publickey) successful!
-2024-12-13 23:18:21,068 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:18:21,124 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:18:21,227 - INFO - ===============================================
-2024-12-13 23:18:21,227 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:19:14,917 - INFO - Circuit initialization time: 53.689933 seconds.
-2024-12-13 23:19:14,917 - INFO - Estimating logical resources...
-2024-12-13 23:19:24,273 - INFO - Resource estimation time (seconds): 9.355477
-2024-12-13 23:19:24,273 - INFO - Analyzing task 742be33c-0982-4b06-b324-1d86242e28d9...
-2024-12-13 23:19:24,273 - INFO - number of supporting files: 1
-2024-12-13 23:19:24,273 - INFO - supporting data file UUID: 7db0f859-073f-46af-9325-016a67229a4b.
-2024-12-13 23:19:24,273 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz.
-2024-12-13 23:19:24,273 - INFO - assuming fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz is an FCIDUMP file.
-2024-12-13 23:19:24,273 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz...
-2024-12-13 23:19:24,278 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:19:24,806 - INFO - Authentication (publickey) successful!
-2024-12-13 23:19:24,820 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:19:24,921 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:19:25,348 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-13 23:19:25,348 - INFO - Analyzing task 3b49563d-948a-4ecb-84a0-d3c0c2c0d217...
-2024-12-13 23:19:25,348 - INFO - number of supporting files: 1
-2024-12-13 23:19:25,348 - INFO - supporting data file UUID: 2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.
-2024-12-13 23:19:25,348 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz.
-2024-12-13 23:19:25,348 - INFO - assuming fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz is an FCIDUMP file.
-2024-12-13 23:19:25,348 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz...
-2024-12-13 23:19:25,353 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:19:25,888 - INFO - Authentication (publickey) successful!
-2024-12-13 23:19:25,903 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:19:26,012 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:19:26,559 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:19:26,559 - INFO - Analyzing task 950da653-13ce-4cd7-95d8-5045ab03d4bc...
-2024-12-13 23:19:26,559 - INFO - number of supporting files: 1
-2024-12-13 23:19:26,559 - INFO - supporting data file UUID: a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.
-2024-12-13 23:19:26,559 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz.
-2024-12-13 23:19:26,559 - INFO - assuming fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz is an FCIDUMP file.
-2024-12-13 23:19:26,559 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz...
-2024-12-13 23:19:26,564 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:19:27,094 - INFO - Authentication (publickey) successful!
-2024-12-13 23:19:27,110 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:19:27,160 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:19:27,197 - INFO - ===============================================
-2024-12-13 23:19:27,198 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:19:51,214 - INFO - Circuit initialization time: 24.016083 seconds.
-2024-12-13 23:19:51,214 - INFO - Estimating logical resources...
-2024-12-13 23:19:56,190 - INFO - Resource estimation time (seconds): 4.975797
-2024-12-13 23:19:56,190 - INFO - Analyzing task 13821f5c-78a6-485c-9006-a17a234cde9f...
-2024-12-13 23:19:56,190 - INFO - number of supporting files: 1
-2024-12-13 23:19:56,190 - INFO - supporting data file UUID: d9707874-28d5-48b6-824e-a2e6c8753437.
-2024-12-13 23:19:56,190 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz.
-2024-12-13 23:19:56,190 - INFO - assuming fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz is an FCIDUMP file.
-2024-12-13 23:19:56,190 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz...
-2024-12-13 23:19:56,198 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:19:56,689 - INFO - Authentication (publickey) successful!
-2024-12-13 23:19:56,707 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:19:56,769 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:19:56,848 - INFO - ===============================================
-2024-12-13 23:19:56,848 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:20:50,528 - INFO - Circuit initialization time: 53.679979 seconds.
-2024-12-13 23:20:50,528 - INFO - Estimating logical resources...
-2024-12-13 23:20:59,906 - INFO - Resource estimation time (seconds): 9.377233
-2024-12-13 23:20:59,906 - INFO - Analyzing task 765594e5-44ac-41a2-89a7-f2ac03536379...
-2024-12-13 23:20:59,906 - INFO - number of supporting files: 1
-2024-12-13 23:20:59,906 - INFO - supporting data file UUID: 727ab190-e399-4bb6-a9b3-20ae57789bac.
-2024-12-13 23:20:59,906 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz.
-2024-12-13 23:20:59,906 - INFO - assuming fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz is an FCIDUMP file.
-2024-12-13 23:20:59,906 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz...
-2024-12-13 23:20:59,911 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:21:00,432 - INFO - Authentication (publickey) successful!
-2024-12-13 23:21:00,449 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:21:00,573 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:21:01,004 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-13 23:21:01,004 - INFO - Analyzing task 858b9683-fc6c-4ebe-8c33-27f0d848f24f...
-2024-12-13 23:21:01,004 - INFO - number of supporting files: 1
-2024-12-13 23:21:01,004 - INFO - supporting data file UUID: e986eb83-6b9d-439e-85ca-a9b931eef4a2.
-2024-12-13 23:21:01,004 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz.
-2024-12-13 23:21:01,004 - INFO - assuming fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz is an FCIDUMP file.
-2024-12-13 23:21:01,004 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz...
-2024-12-13 23:21:01,009 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:21:01,551 - INFO - Authentication (publickey) successful!
-2024-12-13 23:21:01,570 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:21:01,680 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:21:02,268 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:21:02,268 - INFO - Analyzing task 1a013e9f-7eab-4a1b-b486-1d9e2d99e754...
-2024-12-13 23:21:02,268 - INFO - number of supporting files: 1
-2024-12-13 23:21:02,268 - INFO - supporting data file UUID: 6bf3207c-664b-4ed3-8e74-82b42e277234.
-2024-12-13 23:21:02,268 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz.
-2024-12-13 23:21:02,268 - INFO - assuming fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz is an FCIDUMP file.
-2024-12-13 23:21:02,268 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz...
-2024-12-13 23:21:02,273 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:21:02,793 - INFO - Authentication (publickey) successful!
-2024-12-13 23:21:02,806 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:21:02,869 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:21:02,913 - INFO - ===============================================
-2024-12-13 23:21:02,913 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:21:32,811 - INFO - Circuit initialization time: 29.89798 seconds.
-2024-12-13 23:21:32,811 - INFO - Estimating logical resources...
-2024-12-13 23:21:38,456 - INFO - Resource estimation time (seconds): 5.644822
-2024-12-13 23:21:38,456 - INFO - Analyzing task 001a0d11-165a-49c5-a334-643023029f40...
-2024-12-13 23:21:38,456 - INFO - number of supporting files: 1
-2024-12-13 23:21:38,456 - INFO - supporting data file UUID: fb3ecfad-6450-423e-aa58-d5cddab6f0f6.
-2024-12-13 23:21:38,456 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz.
-2024-12-13 23:21:38,457 - INFO - assuming fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz is an FCIDUMP file.
-2024-12-13 23:21:38,457 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz...
-2024-12-13 23:21:38,461 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:21:38,966 - INFO - Authentication (publickey) successful!
-2024-12-13 23:21:38,979 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:21:39,049 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:21:39,252 - INFO - ===============================================
-2024-12-13 23:21:39,253 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:24:03,647 - INFO - Circuit initialization time: 144.394194 seconds.
-2024-12-13 23:24:03,647 - INFO - Estimating logical resources...
-2024-12-13 23:24:24,591 - INFO - Resource estimation time (seconds): 20.94351
-2024-12-13 23:24:24,591 - INFO - Analyzing task 1c9508e3-b9fe-44f1-ae58-c6339ef43f47...
-2024-12-13 23:24:24,592 - INFO - number of supporting files: 1
-2024-12-13 23:24:24,592 - INFO - supporting data file UUID: dc406285-bac1-4b99-afbf-06728b7d699b.
-2024-12-13 23:24:24,592 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz.
-2024-12-13 23:24:24,592 - INFO - assuming fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz is an FCIDUMP file.
-2024-12-13 23:24:24,592 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz...
-2024-12-13 23:24:24,598 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:24:25,142 - INFO - Authentication (publickey) successful!
-2024-12-13 23:24:25,157 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:24:25,266 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:24:25,729 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-13 23:24:25,729 - INFO - Analyzing task 6713517a-ab65-4381-aae1-0839dcd6c1a0...
-2024-12-13 23:24:25,729 - INFO - number of supporting files: 1
-2024-12-13 23:24:25,729 - INFO - supporting data file UUID: af9d6a83-7898-4c13-80eb-a83a533ebf2d.
-2024-12-13 23:24:25,729 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz.
-2024-12-13 23:24:25,729 - INFO - assuming fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz is an FCIDUMP file.
-2024-12-13 23:24:25,729 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz...
-2024-12-13 23:24:25,734 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:24:26,242 - INFO - Authentication (publickey) successful!
-2024-12-13 23:24:26,256 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:24:26,348 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:24:26,894 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:24:26,897 - INFO - parsing ../problem_instances/problem_instance.benzene.f377cc27-366a-45af-b45a-c8478e4b6199.json
-2024-12-13 23:24:26,903 - INFO - problem_instance UUID: f377cc27-366a-45af-b45a-c8478e4b6199
-2024-12-13 23:24:26,903 - INFO - problem_instance short name: benzene
-2024-12-13 23:24:26,903 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:24:26,915 - INFO - Analyzing task b86457a4-abf4-43c9-9c08-2397e95b7c0f...
-2024-12-13 23:24:26,915 - INFO - number of supporting files: 1
-2024-12-13 23:24:26,915 - INFO - supporting data file UUID: 4c655f65-1899-469c-975a-a3caec750697.
-2024-12-13 23:24:26,916 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz.
-2024-12-13 23:24:26,916 - INFO - assuming FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz is an FCIDUMP file.
-2024-12-13 23:24:26,916 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz...
-2024-12-13 23:24:26,920 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:24:27,426 - INFO - Authentication (publickey) successful!
-2024-12-13 23:24:27,441 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:24:27,512 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:24:27,617 - INFO - ===============================================
-2024-12-13 23:24:27,618 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 396 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 398 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 399 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 400 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 401 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 402 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 403 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 404 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 405 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 406 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 407 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-13 23:25:58,148 - INFO - Circuit initialization time: 90.530873 seconds.
-2024-12-13 23:25:58,149 - INFO - Estimating logical resources...
-2024-12-13 23:26:17,129 - INFO - Resource estimation time (seconds): 18.980482
-2024-12-13 23:26:17,129 - INFO - Analyzing task 7148b36a-0571-4a41-9239-19a97339f68a...
-2024-12-13 23:26:17,130 - INFO - number of supporting files: 1
-2024-12-13 23:26:17,130 - INFO - supporting data file UUID: 96ff0e22-a3ab-49f3-aee9-9a1886cbf850.
-2024-12-13 23:26:17,130 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz.
-2024-12-13 23:26:17,130 - INFO - assuming FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz is an FCIDUMP file.
-2024-12-13 23:26:17,130 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz...
-2024-12-13 23:26:17,135 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:26:17,662 - INFO - Authentication (publickey) successful!
-2024-12-13 23:26:17,676 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:26:41,734 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:27:02,621 - INFO - Skipping Logical Resource Estimate because number of orbitals (108) exceeds maximum specified in config (32).
-2024-12-13 23:27:02,631 - INFO - parsing ../problem_instances/problem_instance.Cr_1.02a8c4e9-9d15-4742-b4cc-7f47f69da0e5.json
-2024-12-13 23:27:02,631 - INFO - problem_instance UUID: 02a8c4e9-9d15-4742-b4cc-7f47f69da0e5
-2024-12-13 23:27:02,632 - INFO - problem_instance short name: Cr_1
-2024-12-13 23:27:02,632 - INFO - contains 3 associated Hamiltonians.
-2024-12-13 23:27:02,644 - INFO - Analyzing task b24b71b9-971a-4aca-9fc0-7198d16ca9ed...
-2024-12-13 23:27:02,644 - INFO - number of supporting files: 2
-2024-12-13 23:27:02,644 - INFO - supporting data file UUID: 69a1826c-1bee-4855-8f5f-5df29035bfca.
-2024-12-13 23:27:02,644 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz.
-2024-12-13 23:27:02,644 - INFO - assuming fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz is an FCIDUMP file.
-2024-12-13 23:27:02,644 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz...
-2024-12-13 23:27:02,649 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:27:03,184 - INFO - Authentication (publickey) successful!
-2024-12-13 23:27:03,200 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:27:03,497 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:27:05,226 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-13 23:27:05,226 - INFO - supporting data file UUID: 4ead3f70-392f-45e8-aa0d-f5e364d389d7.
-2024-12-13 23:27:05,226 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vdz.4ead3f70-392f-45e8-aa0d-f5e364d389d7.chk.
-2024-12-13 23:27:05,227 - INFO - assuming Cr1_vdz.4ead3f70-392f-45e8-aa0d-f5e364d389d7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:27:05,227 - INFO - Analyzing task e604a906-55fa-4b3f-bf17-c24a30312b84...
-2024-12-13 23:27:05,227 - INFO - number of supporting files: 2
-2024-12-13 23:27:05,227 - INFO - supporting data file UUID: 4e3649dd-9050-4acc-93f6-a09c962e89d7.
-2024-12-13 23:27:05,227 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz.
-2024-12-13 23:27:05,227 - INFO - assuming fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz is an FCIDUMP file.
-2024-12-13 23:27:05,227 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz...
-2024-12-13 23:27:05,232 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:27:05,739 - INFO - Authentication (publickey) successful!
-2024-12-13 23:27:05,753 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:31:58,507 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:33:19,235 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-13 23:33:19,235 - INFO - supporting data file UUID: ad74c129-2df4-4066-8972-6c0105bc0fa7.
-2024-12-13 23:33:19,235 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vqz.ad74c129-2df4-4066-8972-6c0105bc0fa7.chk.
-2024-12-13 23:33:19,235 - INFO - assuming Cr1_vqz.ad74c129-2df4-4066-8972-6c0105bc0fa7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:33:19,235 - INFO - Analyzing task f4b120e9-acd0-4c7c-89e2-cc082f52f5cf...
-2024-12-13 23:33:19,235 - INFO - number of supporting files: 2
-2024-12-13 23:33:19,235 - INFO - supporting data file UUID: efaceb68-6fae-491a-bb90-1e3e3463f010.
-2024-12-13 23:33:19,235 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz.
-2024-12-13 23:33:19,235 - INFO - assuming fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz is an FCIDUMP file.
-2024-12-13 23:33:19,235 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz...
-2024-12-13 23:33:19,240 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:33:19,778 - INFO - Authentication (publickey) successful!
-2024-12-13 23:33:19,792 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:33:29,846 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:33:42,044 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-13 23:33:42,044 - INFO - supporting data file UUID: 94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.
-2024-12-13 23:33:42,044 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vtz.94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.chk.
-2024-12-13 23:33:42,044 - INFO - assuming Cr1_vtz.94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:33:42,049 - INFO - parsing ../problem_instances/problem_instance.Ti_1.9823b0dd-87b6-4793-9741-e8cbcf2b50c0.json
-2024-12-13 23:33:42,049 - INFO - problem_instance UUID: 9823b0dd-87b6-4793-9741-e8cbcf2b50c0
-2024-12-13 23:33:42,049 - INFO - problem_instance short name: Ti_1
-2024-12-13 23:33:42,049 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:33:42,062 - INFO - Analyzing task 2cd76a23-0514-458a-b588-94e2d10564d3...
-2024-12-13 23:33:42,063 - INFO - number of supporting files: 2
-2024-12-13 23:33:42,063 - INFO - supporting data file UUID: 760e312c-9982-486d-b50e-d9acb003aedc.
-2024-12-13 23:33:42,063 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz.
-2024-12-13 23:33:42,063 - INFO - assuming fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz is an FCIDUMP file.
-2024-12-13 23:33:42,063 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz...
-2024-12-13 23:33:42,067 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:33:42,591 - INFO - Authentication (publickey) successful!
-2024-12-13 23:33:42,606 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:33:43,446 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:33:46,388 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-13 23:33:46,389 - INFO - supporting data file UUID: c4414ea6-320e-4c98-89ef-cc16d7932fd7.
-2024-12-13 23:33:46,389 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti1_vdz.c4414ea6-320e-4c98-89ef-cc16d7932fd7.chk.
-2024-12-13 23:33:46,389 - INFO - assuming Ti1_vdz.c4414ea6-320e-4c98-89ef-cc16d7932fd7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:33:46,389 - INFO - Analyzing task c7049602-5460-4277-8148-d9c66012f8f0...
-2024-12-13 23:33:46,389 - INFO - number of supporting files: 2
-2024-12-13 23:33:46,389 - INFO - supporting data file UUID: 2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.
-2024-12-13 23:33:46,389 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz.
-2024-12-13 23:33:46,389 - INFO - assuming fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz is an FCIDUMP file.
-2024-12-13 23:33:46,389 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz...
-2024-12-13 23:33:46,393 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:33:46,945 - INFO - Authentication (publickey) successful!
-2024-12-13 23:33:46,967 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:34:07,739 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:34:31,943 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-13 23:34:31,943 - INFO - supporting data file UUID: 1391b3e4-1862-4808-8990-dab576dade6a.
-2024-12-13 23:34:31,943 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti1_vtz.1391b3e4-1862-4808-8990-dab576dade6a.chk.
-2024-12-13 23:34:31,943 - INFO - assuming Ti1_vtz.1391b3e4-1862-4808-8990-dab576dade6a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:34:31,950 - INFO - parsing ../problem_instances/problem_instance.V_0.a14a1e28-71c5-4e23-bf6e-dd9662a6df58.json
-2024-12-13 23:34:31,951 - INFO - problem_instance UUID: a14a1e28-71c5-4e23-bf6e-dd9662a6df58
-2024-12-13 23:34:31,951 - INFO - problem_instance short name: V_0
-2024-12-13 23:34:31,951 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:34:31,967 - INFO - Analyzing task 0f0c8766-4bf5-4c1e-991a-9dafe9bc8f27...
-2024-12-13 23:34:31,967 - INFO - number of supporting files: 2
-2024-12-13 23:34:31,968 - INFO - supporting data file UUID: 950e31e2-142f-480b-b0d1-174381bdb64a.
-2024-12-13 23:34:31,968 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz.
-2024-12-13 23:34:31,968 - INFO - assuming fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz is an FCIDUMP file.
-2024-12-13 23:34:31,968 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz...
-2024-12-13 23:34:31,972 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:34:32,640 - INFO - Authentication (publickey) successful!
-2024-12-13 23:34:32,659 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:34:33,531 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:34:37,113 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-13 23:34:37,113 - INFO - supporting data file UUID: 5b236de2-1bb4-442b-8519-0af6e44d857d.
-2024-12-13 23:34:37,113 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V0_vdz.5b236de2-1bb4-442b-8519-0af6e44d857d.chk.
-2024-12-13 23:34:37,113 - INFO - assuming V0_vdz.5b236de2-1bb4-442b-8519-0af6e44d857d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:34:37,113 - INFO - Analyzing task 338f4b6e-775c-413b-a508-9132659ebbc3...
-2024-12-13 23:34:37,113 - INFO - number of supporting files: 2
-2024-12-13 23:34:37,113 - INFO - supporting data file UUID: d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.
-2024-12-13 23:34:37,113 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz.
-2024-12-13 23:34:37,114 - INFO - assuming fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz is an FCIDUMP file.
-2024-12-13 23:34:37,114 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz...
-2024-12-13 23:34:37,119 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:34:37,642 - INFO - Authentication (publickey) successful!
-2024-12-13 23:34:37,660 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:35:18,249 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:35:49,542 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-13 23:35:49,543 - INFO - supporting data file UUID: 1c843e96-bab4-4f23-8a9e-df61638fb804.
-2024-12-13 23:35:49,543 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V0_vtz.1c843e96-bab4-4f23-8a9e-df61638fb804.chk.
-2024-12-13 23:35:49,543 - INFO - assuming V0_vtz.1c843e96-bab4-4f23-8a9e-df61638fb804.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:35:49,554 - INFO - parsing ../problem_instances/problem_instance.CuO_0.886ad5bf-d487-48c8-b08c-c9f82b84ed5d.json
-2024-12-13 23:35:49,555 - INFO - problem_instance UUID: 886ad5bf-d487-48c8-b08c-c9f82b84ed5d
-2024-12-13 23:35:49,555 - INFO - problem_instance short name: CuO_0
-2024-12-13 23:35:49,555 - INFO - contains 1 associated Hamiltonians.
-2024-12-13 23:35:49,575 - INFO - Analyzing task 37e1f17b-384d-423d-860b-c75b9dcff951...
-2024-12-13 23:35:49,575 - INFO - number of supporting files: 2
-2024-12-13 23:35:49,575 - INFO - supporting data file UUID: da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.
-2024-12-13 23:35:49,575 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz.
-2024-12-13 23:35:49,575 - INFO - assuming fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz is an FCIDUMP file.
-2024-12-13 23:35:49,575 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz...
-2024-12-13 23:35:49,583 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:35:50,232 - INFO - Authentication (publickey) successful!
-2024-12-13 23:35:50,253 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:35:59,968 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:36:11,667 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-13 23:36:11,667 - INFO - supporting data file UUID: c4e62caf-cab0-444f-88f2-ce58f87079f2.
-2024-12-13 23:36:11,667 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/CuO_vdz.c4e62caf-cab0-444f-88f2-ce58f87079f2.chk.
-2024-12-13 23:36:11,667 - INFO - assuming CuO_vdz.c4e62caf-cab0-444f-88f2-ce58f87079f2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:36:11,669 - INFO - parsing ../problem_instances/problem_instance.TiO_0.0b91f99e-8de5-415d-a78e-f80e45d621ca.json
-2024-12-13 23:36:11,669 - INFO - problem_instance UUID: 0b91f99e-8de5-415d-a78e-f80e45d621ca
-2024-12-13 23:36:11,669 - INFO - problem_instance short name: TiO_0
-2024-12-13 23:36:11,669 - INFO - contains 1 associated Hamiltonians.
-2024-12-13 23:36:11,681 - INFO - Analyzing task 84aa9e2d-18e6-4689-9274-28e89ef44080...
-2024-12-13 23:36:11,681 - INFO - number of supporting files: 2
-2024-12-13 23:36:11,681 - INFO - supporting data file UUID: 98719f34-8ba8-4557-a9fd-b28a84fe7dd1.
-2024-12-13 23:36:11,681 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz.
-2024-12-13 23:36:11,681 - INFO - assuming fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz is an FCIDUMP file.
-2024-12-13 23:36:11,681 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz...
-2024-12-13 23:36:11,688 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:36:12,200 - INFO - Authentication (publickey) successful!
-2024-12-13 23:36:12,215 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:36:20,251 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:36:34,248 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-13 23:36:34,248 - INFO - supporting data file UUID: bee1776c-8031-4f23-a403-4475699e873f.
-2024-12-13 23:36:34,248 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/TiO_vdz.bee1776c-8031-4f23-a403-4475699e873f.chk.
-2024-12-13 23:36:34,248 - INFO - assuming TiO_vdz.bee1776c-8031-4f23-a403-4475699e873f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:36:34,251 - INFO - parsing ../problem_instances/problem_instance.na2_0.edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76.json
-2024-12-13 23:36:34,251 - INFO - problem_instance UUID: edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76
-2024-12-13 23:36:34,251 - INFO - problem_instance short name: na2_0
-2024-12-13 23:36:34,251 - INFO - contains 3 associated Hamiltonians.
-2024-12-13 23:36:34,267 - INFO - Analyzing task 4fb7e994-8e7a-4acd-86d4-bb52db824cfc...
-2024-12-13 23:36:34,267 - INFO - number of supporting files: 2
-2024-12-13 23:36:34,267 - INFO - supporting data file UUID: 4ceb8edc-937e-4cb6-9e42-51b6760b2557.
-2024-12-13 23:36:34,267 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz.
-2024-12-13 23:36:34,268 - INFO - assuming fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz is an FCIDUMP file.
-2024-12-13 23:36:34,268 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz...
-2024-12-13 23:36:34,274 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:36:34,946 - INFO - Authentication (publickey) successful!
-2024-12-13 23:36:34,961 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:36:35,082 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:36:35,783 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-13 23:36:35,784 - INFO - supporting data file UUID: 2014a3d7-1779-4d85-810f-ab908557987f.
-2024-12-13 23:36:35,784 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVDZ.2014a3d7-1779-4d85-810f-ab908557987f.chk.
-2024-12-13 23:36:35,784 - INFO - assuming na2_cc-pVDZ.2014a3d7-1779-4d85-810f-ab908557987f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:36:35,784 - INFO - Analyzing task f96de7fe-5c88-4083-8c48-72bc094cccfd...
-2024-12-13 23:36:35,784 - INFO - number of supporting files: 2
-2024-12-13 23:36:35,784 - INFO - supporting data file UUID: 4d93ba0f-4ad6-4107-b495-9284d226e13d.
-2024-12-13 23:36:35,784 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz.
-2024-12-13 23:36:35,784 - INFO - assuming fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz is an FCIDUMP file.
-2024-12-13 23:36:35,784 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz...
-2024-12-13 23:36:35,789 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:36:36,406 - INFO - Authentication (publickey) successful!
-2024-12-13 23:36:36,421 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:38:39,847 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:39:35,605 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-13 23:39:35,605 - INFO - supporting data file UUID: 299611a7-6df9-4cdd-ada5-ae74e038f77c.
-2024-12-13 23:39:35,605 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVQZ.299611a7-6df9-4cdd-ada5-ae74e038f77c.chk.
-2024-12-13 23:39:35,606 - INFO - assuming na2_cc-pVQZ.299611a7-6df9-4cdd-ada5-ae74e038f77c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:39:35,606 - INFO - Analyzing task 620e9ff4-07bf-4767-9237-d39aa659b8e5...
-2024-12-13 23:39:35,606 - INFO - number of supporting files: 2
-2024-12-13 23:39:35,606 - INFO - supporting data file UUID: c288da42-cf53-4437-a310-24bf3e35e008.
-2024-12-13 23:39:35,606 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz.
-2024-12-13 23:39:35,606 - INFO - assuming fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz is an FCIDUMP file.
-2024-12-13 23:39:35,606 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz...
-2024-12-13 23:39:35,611 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:39:36,141 - INFO - Authentication (publickey) successful!
-2024-12-13 23:39:36,155 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:39:37,956 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:39:43,351 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-13 23:39:43,352 - INFO - supporting data file UUID: 74e99e36-315d-4e29-a4c9-2ae0b1c932d6.
-2024-12-13 23:39:43,352 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVTZ.74e99e36-315d-4e29-a4c9-2ae0b1c932d6.chk.
-2024-12-13 23:39:43,352 - INFO - assuming na2_cc-pVTZ.74e99e36-315d-4e29-a4c9-2ae0b1c932d6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:39:43,354 - INFO - parsing ../problem_instances/problem_instance.mn_mono.cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8.json
-2024-12-13 23:39:43,390 - INFO - problem_instance UUID: cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8
-2024-12-13 23:39:43,390 - INFO - problem_instance short name: mn_mono
-2024-12-13 23:39:43,390 - INFO - contains 8 associated Hamiltonians.
-2024-12-13 23:39:43,402 - INFO - Analyzing task de3ea361-c2d3-4ab6-add4-ccd43cea6aa8...
-2024-12-13 23:39:43,403 - INFO - number of supporting files: 1
-2024-12-13 23:39:43,403 - INFO - supporting data file UUID: 68af0b80-3d27-4aba-84f9-bcdd30a9255b.
-2024-12-13 23:39:43,403 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz.
-2024-12-13 23:39:43,403 - INFO - assuming fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz is an FCIDUMP file.
-2024-12-13 23:39:43,403 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz...
-2024-12-13 23:39:43,407 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:39:43,931 - INFO - Authentication (publickey) successful!
-2024-12-13 23:39:43,947 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:39:44,002 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:39:44,017 - INFO - ===============================================
-2024-12-13 23:39:44,017 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:39:53,709 - INFO - Circuit initialization time: 9.692099 seconds.
-2024-12-13 23:39:53,709 - INFO - Estimating logical resources...
-2024-12-13 23:39:56,340 - INFO - Resource estimation time (seconds): 2.631003
-2024-12-13 23:39:56,341 - INFO - Analyzing task 6c39d3a7-c71a-4049-a8c7-3a3a4b61d8da...
-2024-12-13 23:39:56,341 - INFO - number of supporting files: 1
-2024-12-13 23:39:56,341 - INFO - supporting data file UUID: 28a7820f-63fe-4920-aeec-a7ffe7e55d83.
-2024-12-13 23:39:56,341 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz.
-2024-12-13 23:39:56,341 - INFO - assuming fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz is an FCIDUMP file.
-2024-12-13 23:39:56,341 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz...
-2024-12-13 23:39:56,346 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:39:56,849 - INFO - Authentication (publickey) successful!
-2024-12-13 23:39:56,864 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:39:56,980 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:39:57,247 - INFO - ===============================================
-2024-12-13 23:39:57,248 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 462 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-13 23:43:11,632 - INFO - Circuit initialization time: 194.384515 seconds.
-2024-12-13 23:43:11,633 - INFO - Estimating logical resources...
-2024-12-13 23:43:38,329 - INFO - Resource estimation time (seconds): 26.696127
-2024-12-13 23:43:38,329 - INFO - Analyzing task 1ade03f3-06b1-4e95-b271-fea5a6343829...
-2024-12-13 23:43:38,329 - INFO - number of supporting files: 1
-2024-12-13 23:43:38,330 - INFO - supporting data file UUID: f738fcd6-7ddc-4d70-8ff9-4019e3718b04.
-2024-12-13 23:43:38,330 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz.
-2024-12-13 23:43:38,330 - INFO - assuming fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz is an FCIDUMP file.
-2024-12-13 23:43:38,330 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz...
-2024-12-13 23:43:38,335 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:43:38,851 - INFO - Authentication (publickey) successful!
-2024-12-13 23:43:38,864 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:43:38,917 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:43:38,934 - INFO - ===============================================
-2024-12-13 23:43:38,934 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:43:48,530 - INFO - Circuit initialization time: 9.596358 seconds.
-2024-12-13 23:43:48,531 - INFO - Estimating logical resources...
-2024-12-13 23:43:51,331 - INFO - Resource estimation time (seconds): 2.800315
-2024-12-13 23:43:51,332 - INFO - Analyzing task ff0da1e2-2c76-4589-aefa-c13bb1a1ef8f...
-2024-12-13 23:43:51,332 - INFO - number of supporting files: 1
-2024-12-13 23:43:51,332 - INFO - supporting data file UUID: 6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.
-2024-12-13 23:43:51,332 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz.
-2024-12-13 23:43:51,332 - INFO - assuming fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz is an FCIDUMP file.
-2024-12-13 23:43:51,333 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz...
-2024-12-13 23:43:51,337 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:43:51,856 - INFO - Authentication (publickey) successful!
-2024-12-13 23:43:51,868 - INFO - [chan 0] Opened sftp connection (server version 3)
-Downloading gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz to fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz...
-Parsing fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52
-Downloading gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz to fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz...
-Parsing fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a
-Downloading gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz to fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz...
-Parsing fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a
-Downloading gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz to fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz...
-Parsing fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258
-Downloading gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz to fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz...
-Parsing fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16
-Downloading gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz to fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz...
-Parsing fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b
-Downloading gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz to fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz...
-Parsing fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29
-Detected IPython. Loading juliacall extension. See https://juliapy.github.io/PythonCall.jl/stable/compat/#IPython
-Downloading gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz to fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz...
-Parsing fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5
-Downloading gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz to fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz...
-Parsing fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b
-Downloading gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz to fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz...
-Parsing fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b
-Downloading gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz to fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz...
-Parsing fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae
-Downloading gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz to fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz...
-Parsing fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437
-Downloading gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz to fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz...
-Parsing fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac
-Downloading gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz to fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz...
-Parsing fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2
-Downloading gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz to fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz...
-Parsing fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234
-Downloading gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz to fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz...
-Parsing fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6
-Downloading gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz to fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz...
-Parsing fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b
-Downloading gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz to fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz...
-Parsing fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d
-Downloading gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz to FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz...
-Parsing FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697
-Downloading gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz to FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz...
-Parsing FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850
-Downloading gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz to fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz...
-Parsing fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca
-Downloading gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz to fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz...
-Parsing fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7
-Downloading gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz to fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz...
-Parsing fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010
-Downloading gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz to fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz...
-Parsing fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc
-Downloading gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz to fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz...
-Parsing fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9
-Downloading gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz to fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz...
-Parsing fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a
-Downloading gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz to fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz...
-Parsing fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd
-Downloading gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz to fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz...
-Parsing fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab
-Downloading gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz to fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz...
-Parsing fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1
-Downloading gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz to fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz...
-Parsing fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557
-Downloading gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz to fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz...
-Parsing fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d
-Downloading gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz to fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz...
-Parsing fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008
-Downloading gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz to fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz...
-Parsing fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b
-Downloading gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz to fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz...
-Parsing fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83
-Downloading gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz to fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz...
-Parsing fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04
-2024-12-13 23:43:51,988 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:43:52,312 - INFO - ===============================================
-2024-12-13 23:43:52,312 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:47:35,196 - INFO - Circuit initialization time: 222.883763 seconds.
-2024-12-13 23:47:35,196 - INFO - Estimating logical resources...
-2024-12-13 23:48:05,199 - INFO - Resource estimation time (seconds): 30.002143
-2024-12-13 23:48:05,199 - INFO - Analyzing task a9c90f98-6557-44d2-9ca0-0c9122f4080c...
-2024-12-13 23:48:05,199 - INFO - number of supporting files: 1
-2024-12-13 23:48:05,199 - INFO - supporting data file UUID: 027490ba-34f9-4340-89ab-27fd110d2821.
-2024-12-13 23:48:05,200 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz.
-2024-12-13 23:48:05,200 - INFO - assuming fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz is an FCIDUMP file.
-2024-12-13 23:48:05,200 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz...
-2024-12-13 23:48:05,205 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:48:05,745 - INFO - Authentication (publickey) successful!
-2024-12-13 23:48:05,762 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:48:05,835 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:48:05,854 - INFO - ===============================================
-2024-12-13 23:48:05,855 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:48:15,682 - INFO - Circuit initialization time: 9.827025 seconds.
-2024-12-13 23:48:15,682 - INFO - Estimating logical resources...
-2024-12-13 23:48:18,391 - INFO - Resource estimation time (seconds): 2.709139
-2024-12-13 23:48:18,392 - INFO - Analyzing task a16168e2-98cd-430d-a180-84f64b4d5e75...
-2024-12-13 23:48:18,392 - INFO - number of supporting files: 1
-2024-12-13 23:48:18,392 - INFO - supporting data file UUID: bae2da57-6a69-483e-95bc-b77f72ebfba8.
-2024-12-13 23:48:18,392 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz.
-2024-12-13 23:48:18,392 - INFO - assuming fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz is an FCIDUMP file.
-2024-12-13 23:48:18,393 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz...
-2024-12-13 23:48:18,398 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:48:18,915 - INFO - Authentication (publickey) successful!
-2024-12-13 23:48:18,930 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:48:19,015 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:48:19,332 - INFO - ===============================================
-2024-12-13 23:48:19,332 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:52:05,551 - INFO - Circuit initialization time: 226.21892 seconds.
-2024-12-13 23:52:05,552 - INFO - Estimating logical resources...
-2024-12-13 23:52:36,135 - INFO - Resource estimation time (seconds): 30.583492
-2024-12-13 23:52:36,136 - INFO - Analyzing task 590c2f0b-964b-4d09-96ad-101a9be59cab...
-2024-12-13 23:52:36,136 - INFO - number of supporting files: 1
-2024-12-13 23:52:36,136 - INFO - supporting data file UUID: 72343006-774e-4192-b481-fa840ed25573.
-2024-12-13 23:52:36,137 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz.
-2024-12-13 23:52:36,137 - INFO - assuming fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz is an FCIDUMP file.
-2024-12-13 23:52:36,137 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz...
-2024-12-13 23:52:36,143 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:52:36,681 - INFO - Authentication (publickey) successful!
-2024-12-13 23:52:36,695 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:52:36,742 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:52:36,758 - INFO - ===============================================
-2024-12-13 23:52:36,758 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-13 23:52:46,697 - INFO - Circuit initialization time: 9.938555 seconds.
-2024-12-13 23:52:46,697 - INFO - Estimating logical resources...
-2024-12-13 23:52:49,520 - INFO - Resource estimation time (seconds): 2.823163
-2024-12-13 23:52:49,521 - INFO - Analyzing task 6e617348-d0b3-4b6d-9923-ea54ba5cf751...
-2024-12-13 23:52:49,521 - INFO - number of supporting files: 1
-2024-12-13 23:52:49,521 - INFO - supporting data file UUID: ea55abec-8253-445d-85fa-914948b5e5a5.
-2024-12-13 23:52:49,521 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz.
-2024-12-13 23:52:49,521 - INFO - assuming fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz is an FCIDUMP file.
-2024-12-13 23:52:49,521 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz...
-2024-12-13 23:52:49,525 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:52:50,063 - INFO - Authentication (publickey) successful!
-2024-12-13 23:52:50,075 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:52:50,154 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:52:50,479 - INFO - ===============================================
-2024-12-13 23:52:50,479 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 494 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-13 23:56:34,310 - INFO - Circuit initialization time: 223.83054 seconds.
-2024-12-13 23:56:34,310 - INFO - Estimating logical resources...
-2024-12-13 23:57:04,410 - INFO - Resource estimation time (seconds): 30.099989
-2024-12-13 23:57:04,412 - INFO - parsing ../problem_instances/problem_instance.FeO_0.55d0ed82-0560-4448-8459-c2ba00654d9d.json
-2024-12-13 23:57:04,412 - INFO - problem_instance UUID: 55d0ed82-0560-4448-8459-c2ba00654d9d
-2024-12-13 23:57:04,412 - INFO - problem_instance short name: FeO_0
-2024-12-13 23:57:04,412 - INFO - contains 1 associated Hamiltonians.
-2024-12-13 23:57:04,424 - INFO - Analyzing task b8344eb5-f574-4198-b917-8312240ba288...
-2024-12-13 23:57:04,424 - INFO - number of supporting files: 2
-2024-12-13 23:57:04,424 - INFO - supporting data file UUID: 3f1777dc-c493-4aa7-b3d1-6271d9bed459.
-2024-12-13 23:57:04,424 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz.
-2024-12-13 23:57:04,424 - INFO - assuming fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz is an FCIDUMP file.
-2024-12-13 23:57:04,424 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz...
-2024-12-13 23:57:04,429 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:57:04,950 - INFO - Authentication (publickey) successful!
-2024-12-13 23:57:04,963 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:57:13,813 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:57:26,978 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-13 23:57:26,978 - INFO - supporting data file UUID: 8bb3298d-0a60-4249-bfc5-94f399fbd522.
-2024-12-13 23:57:26,978 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/FeO_vdz.8bb3298d-0a60-4249-bfc5-94f399fbd522.chk.
-2024-12-13 23:57:26,978 - INFO - assuming FeO_vdz.8bb3298d-0a60-4249-bfc5-94f399fbd522.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:57:26,980 - INFO - parsing ../problem_instances/problem_instance.p_h3_0.0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57.json
-2024-12-13 23:57:26,980 - INFO - problem_instance UUID: 0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57
-2024-12-13 23:57:26,981 - INFO - problem_instance short name: p_h3_0
-2024-12-13 23:57:26,981 - INFO - contains 2 associated Hamiltonians.
-2024-12-13 23:57:26,991 - INFO - Analyzing task af399f2b-a4f8-4fec-aca2-7c126ed989a5...
-2024-12-13 23:57:26,991 - INFO - number of supporting files: 2
-2024-12-13 23:57:26,991 - INFO - supporting data file UUID: 7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.
-2024-12-13 23:57:26,991 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz.
-2024-12-13 23:57:26,991 - INFO - assuming fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz is an FCIDUMP file.
-2024-12-13 23:57:26,991 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz...
-2024-12-13 23:57:26,998 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:57:27,664 - INFO - Authentication (publickey) successful!
-2024-12-13 23:57:27,681 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:57:27,829 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:57:28,843 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-13 23:57:28,844 - INFO - supporting data file UUID: e7dafb07-2975-4414-9924-2f8037778aee.
-2024-12-13 23:57:28,844 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p_h3_cc-pVDZ.e7dafb07-2975-4414-9924-2f8037778aee.chk.
-2024-12-13 23:57:28,844 - INFO - assuming p_h3_cc-pVDZ.e7dafb07-2975-4414-9924-2f8037778aee.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:57:28,844 - INFO - Analyzing task 819ff18a-5aad-46df-83ef-bd209e44936b...
-2024-12-13 23:57:28,844 - INFO - number of supporting files: 2
-2024-12-13 23:57:28,844 - INFO - supporting data file UUID: 2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.
-2024-12-13 23:57:28,845 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz.
-2024-12-13 23:57:28,845 - INFO - assuming fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz is an FCIDUMP file.
-2024-12-13 23:57:28,845 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz...
-2024-12-13 23:57:28,850 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:57:29,514 - INFO - Authentication (publickey) successful!
-2024-12-13 23:57:29,548 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:57:54,033 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:58:17,492 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-13 23:58:17,492 - INFO - supporting data file UUID: b8c794eb-a077-4227-9777-80462e7beefd.
-2024-12-13 23:58:17,492 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p_h3_cc-pVTZ.b8c794eb-a077-4227-9777-80462e7beefd.chk.
-2024-12-13 23:58:17,492 - INFO - assuming p_h3_cc-pVTZ.b8c794eb-a077-4227-9777-80462e7beefd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:58:17,495 - INFO - parsing ../problem_instances/problem_instance.h2_s_0.208f2e50-2b56-4e72-815a-cba5cec1264c.json
-2024-12-13 23:58:17,495 - INFO - problem_instance UUID: 208f2e50-2b56-4e72-815a-cba5cec1264c
-2024-12-13 23:58:17,495 - INFO - problem_instance short name: h2_s_0
-2024-12-13 23:58:17,495 - INFO - contains 3 associated Hamiltonians.
-2024-12-13 23:58:17,507 - INFO - Analyzing task f2f09d9f-8328-4d4a-ba91-089f9e56bf0d...
-2024-12-13 23:58:17,508 - INFO - number of supporting files: 2
-2024-12-13 23:58:17,508 - INFO - supporting data file UUID: 11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.
-2024-12-13 23:58:17,508 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz.
-2024-12-13 23:58:17,508 - INFO - assuming fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz is an FCIDUMP file.
-2024-12-13 23:58:17,508 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz...
-2024-12-13 23:58:17,514 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:58:18,031 - INFO - Authentication (publickey) successful!
-2024-12-13 23:58:18,045 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-13 23:58:18,173 - INFO - [chan 0] sftp session closed.
-2024-12-13 23:58:18,373 - INFO - ===============================================
-2024-12-13 23:58:18,373 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 280 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 281 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 283 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 286 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 287 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 291 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 292 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 293 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 294 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 295 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 296 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 298 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 299 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 301 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 302 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 303 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 304 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 305 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 306 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 307 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 308 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 309 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 310 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 311 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 312 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 313 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 314 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-13 23:59:31,585 - INFO - Circuit initialization time: 73.212291 seconds.
-2024-12-13 23:59:31,585 - INFO - Estimating logical resources...
-2024-12-13 23:59:45,317 - INFO - Resource estimation time (seconds): 13.731639
-2024-12-13 23:59:45,317 - INFO - supporting data file UUID: b28fc567-776a-49e9-b537-f885125f2e41.
-2024-12-13 23:59:45,317 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVDZ.b28fc567-776a-49e9-b537-f885125f2e41.chk.
-2024-12-13 23:59:45,317 - INFO - assuming h2_s_cc-pVDZ.b28fc567-776a-49e9-b537-f885125f2e41.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-13 23:59:45,317 - INFO - Analyzing task 3d5186f9-82b3-4de0-9bc1-242d7bdb678a...
-2024-12-13 23:59:45,318 - INFO - number of supporting files: 2
-2024-12-13 23:59:45,318 - INFO - supporting data file UUID: 57afbbf8-5819-4ee7-b540-95974b8a1a3f.
-2024-12-13 23:59:45,318 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz.
-2024-12-13 23:59:45,318 - INFO - assuming fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz is an FCIDUMP file.
-2024-12-13 23:59:45,318 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz...
-2024-12-13 23:59:45,322 - INFO - Connected (version 2.0, client 0)
-2024-12-13 23:59:45,829 - INFO - Authentication (publickey) successful!
-2024-12-13 23:59:45,846 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:02:26,963 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:03:19,208 - INFO - Skipping Logical Resource Estimate because number of orbitals (119) exceeds maximum specified in config (32).
-2024-12-14 00:03:19,208 - INFO - supporting data file UUID: 6474909a-c9c8-4e8b-be9c-71207ece21ea.
-2024-12-14 00:03:19,208 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVQZ.6474909a-c9c8-4e8b-be9c-71207ece21ea.chk.
-2024-12-14 00:03:19,208 - INFO - assuming h2_s_cc-pVQZ.6474909a-c9c8-4e8b-be9c-71207ece21ea.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:03:19,208 - INFO - Analyzing task ec0baf59-05f5-49df-b5e5-8f887d822a10...
-2024-12-14 00:03:19,208 - INFO - number of supporting files: 2
-2024-12-14 00:03:19,208 - INFO - supporting data file UUID: 83f0f242-e184-4581-a77a-f019731d8a6f.
-2024-12-14 00:03:19,209 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz.
-2024-12-14 00:03:19,209 - INFO - assuming fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz is an FCIDUMP file.
-2024-12-14 00:03:19,209 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz...
-2024-12-14 00:03:19,214 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:03:19,760 - INFO - Authentication (publickey) successful!
-2024-12-14 00:03:19,778 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:03:21,052 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:03:25,154 - INFO - Skipping Logical Resource Estimate because number of orbitals (62) exceeds maximum specified in config (32).
-2024-12-14 00:03:25,154 - INFO - supporting data file UUID: 2081f24a-d7ea-452a-b9bc-9901d06282d6.
-2024-12-14 00:03:25,154 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVTZ.2081f24a-d7ea-452a-b9bc-9901d06282d6.chk.
-2024-12-14 00:03:25,155 - INFO - assuming h2_s_cc-pVTZ.2081f24a-d7ea-452a-b9bc-9901d06282d6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:03:25,156 - INFO - parsing ../problem_instances/problem_instance.Sc_0.67f72316-2262-44fb-8c0a-e159e1cd0cf0.json
-2024-12-14 00:03:25,157 - INFO - problem_instance UUID: 67f72316-2262-44fb-8c0a-e159e1cd0cf0
-2024-12-14 00:03:25,157 - INFO - problem_instance short name: Sc_0
-2024-12-14 00:03:25,157 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:03:25,168 - INFO - Analyzing task fb87d637-aaab-4e8f-8898-4ecca8bd0fe0...
-2024-12-14 00:03:25,168 - INFO - number of supporting files: 2
-2024-12-14 00:03:25,168 - INFO - supporting data file UUID: 9da0b1fb-c6a5-4da5-b390-3920e3c26154.
-2024-12-14 00:03:25,168 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz.
-2024-12-14 00:03:25,168 - INFO - assuming fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz is an FCIDUMP file.
-2024-12-14 00:03:25,168 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz...
-2024-12-14 00:03:25,178 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:03:25,724 - INFO - Authentication (publickey) successful!
-2024-12-14 00:03:25,749 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:03:26,302 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:03:28,672 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 00:03:28,672 - INFO - supporting data file UUID: 11066a5f-4cab-41ed-9bcf-bc34a77d52c6.
-2024-12-14 00:03:28,672 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vdz.11066a5f-4cab-41ed-9bcf-bc34a77d52c6.chk.
-2024-12-14 00:03:28,672 - INFO - assuming Sc0_vdz.11066a5f-4cab-41ed-9bcf-bc34a77d52c6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:03:28,672 - INFO - Analyzing task 96c6a0d7-8a1e-4189-a934-833b80ade346...
-2024-12-14 00:03:28,672 - INFO - number of supporting files: 2
-2024-12-14 00:03:28,672 - INFO - supporting data file UUID: 85c6b46a-59fe-4506-89d3-e6faec2383e2.
-2024-12-14 00:03:28,672 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz.
-2024-12-14 00:03:28,672 - INFO - assuming fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz is an FCIDUMP file.
-2024-12-14 00:03:28,672 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz...
-2024-12-14 00:03:28,677 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:03:29,210 - INFO - Authentication (publickey) successful!
-2024-12-14 00:03:29,228 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:07:06,647 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:08:08,187 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-14 00:08:08,187 - INFO - supporting data file UUID: 814f1b4d-2820-4c3f-8367-05f604deee43.
-2024-12-14 00:08:08,187 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vqz.814f1b4d-2820-4c3f-8367-05f604deee43.chk.
-2024-12-14 00:08:08,187 - INFO - assuming Sc0_vqz.814f1b4d-2820-4c3f-8367-05f604deee43.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:08:08,187 - INFO - Analyzing task dc1da839-0ccc-434c-bf9c-a3874ffc3b1c...
-2024-12-14 00:08:08,187 - INFO - number of supporting files: 2
-2024-12-14 00:08:08,187 - INFO - supporting data file UUID: 83008296-5ec9-4af7-a03b-372025fad080.
-2024-12-14 00:08:08,187 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz.
-2024-12-14 00:08:08,187 - INFO - assuming fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz is an FCIDUMP file.
-2024-12-14 00:08:08,187 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz...
-2024-12-14 00:08:08,191 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:08:08,749 - INFO - Authentication (publickey) successful!
-2024-12-14 00:08:08,765 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:08:15,635 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:08:28,515 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:08:28,515 - INFO - supporting data file UUID: 0a3909ae-25ab-4fd7-8625-12a477404329.
-2024-12-14 00:08:28,515 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vtz.0a3909ae-25ab-4fd7-8625-12a477404329.chk.
-2024-12-14 00:08:28,515 - INFO - assuming Sc0_vtz.0a3909ae-25ab-4fd7-8625-12a477404329.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:08:28,527 - INFO - parsing ../problem_instances/problem_instance.na_cl_0.3f141f05-532b-478d-b38a-2ae07baadc88.json
-2024-12-14 00:08:28,527 - INFO - problem_instance UUID: 3f141f05-532b-478d-b38a-2ae07baadc88
-2024-12-14 00:08:28,527 - INFO - problem_instance short name: na_cl_0
-2024-12-14 00:08:28,527 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:08:28,556 - INFO - Analyzing task da831b60-89ce-4c01-96f9-c9f8a4512aab...
-2024-12-14 00:08:28,556 - INFO - number of supporting files: 2
-2024-12-14 00:08:28,557 - INFO - supporting data file UUID: cd31956d-bef5-4112-9959-510170644e72.
-2024-12-14 00:08:28,557 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz.
-2024-12-14 00:08:28,557 - INFO - assuming fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz is an FCIDUMP file.
-2024-12-14 00:08:28,557 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz...
-2024-12-14 00:08:28,562 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:08:29,244 - INFO - Authentication (publickey) successful!
-2024-12-14 00:08:29,261 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:08:29,347 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:08:30,027 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 00:08:30,027 - INFO - supporting data file UUID: 54f78447-2f62-48c7-a584-037808c4e08c.
-2024-12-14 00:08:30,027 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVDZ.54f78447-2f62-48c7-a584-037808c4e08c.chk.
-2024-12-14 00:08:30,027 - INFO - assuming na_cl_cc-pVDZ.54f78447-2f62-48c7-a584-037808c4e08c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:08:30,027 - INFO - Analyzing task a2f9649f-0f47-4a5d-a6a7-b0bebc848797...
-2024-12-14 00:08:30,028 - INFO - number of supporting files: 2
-2024-12-14 00:08:30,028 - INFO - supporting data file UUID: 677d97ee-5a46-4d49-82d6-ca3fc98a59a7.
-2024-12-14 00:08:30,028 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz.
-2024-12-14 00:08:30,028 - INFO - assuming fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz is an FCIDUMP file.
-2024-12-14 00:08:30,028 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz...
-2024-12-14 00:08:30,034 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:08:30,684 - INFO - Authentication (publickey) successful!
-2024-12-14 00:08:30,700 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:11:06,920 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:06,902 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 00:12:06,902 - INFO - supporting data file UUID: fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.
-2024-12-14 00:12:06,903 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVQZ.fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.chk.
-2024-12-14 00:12:06,903 - INFO - assuming na_cl_cc-pVQZ.fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:12:06,903 - INFO - Analyzing task 01ec60f7-d38a-4c33-a498-659a388e10ee...
-2024-12-14 00:12:06,903 - INFO - number of supporting files: 2
-2024-12-14 00:12:06,903 - INFO - supporting data file UUID: 444f3f27-904b-463f-b2f2-c92686c9637d.
-2024-12-14 00:12:06,903 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz.
-2024-12-14 00:12:06,903 - INFO - assuming fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz is an FCIDUMP file.
-2024-12-14 00:12:06,903 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz...
-2024-12-14 00:12:06,908 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:12:07,455 - INFO - Authentication (publickey) successful!
-2024-12-14 00:12:07,483 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:12:12,623 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:19,297 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 00:12:19,298 - INFO - supporting data file UUID: 0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.
-2024-12-14 00:12:19,298 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVTZ.0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.chk.
-2024-12-14 00:12:19,298 - INFO - assuming na_cl_cc-pVTZ.0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:12:19,300 - INFO - parsing ../problem_instances/problem_instance.c2_h2_0.0ca102a7-dad4-4d42-8c73-9acfa45378d7.json
-2024-12-14 00:12:19,300 - INFO - problem_instance UUID: 0ca102a7-dad4-4d42-8c73-9acfa45378d7
-2024-12-14 00:12:19,300 - INFO - problem_instance short name: c2_h2_0
-2024-12-14 00:12:19,300 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:12:19,314 - INFO - Analyzing task 2761e36e-f001-42af-8086-f507b5643ec8...
-2024-12-14 00:12:19,314 - INFO - number of supporting files: 2
-2024-12-14 00:12:19,314 - INFO - supporting data file UUID: 5b507b3d-b6fc-4e13-9586-06113819d99f.
-2024-12-14 00:12:19,314 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz.
-2024-12-14 00:12:19,314 - INFO - assuming fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz is an FCIDUMP file.
-2024-12-14 00:12:19,314 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz...
-2024-12-14 00:12:19,319 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:12:19,920 - INFO - Authentication (publickey) successful!
-2024-12-14 00:12:19,944 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:12:20,065 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:20,580 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 00:12:20,580 - INFO - supporting data file UUID: 7d37092e-ec2a-4cc0-b18a-211e358f2a3d.
-2024-12-14 00:12:20,580 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h2_cc-pVDZ.7d37092e-ec2a-4cc0-b18a-211e358f2a3d.chk.
-2024-12-14 00:12:20,580 - INFO - assuming c2_h2_cc-pVDZ.7d37092e-ec2a-4cc0-b18a-211e358f2a3d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:12:20,580 - INFO - Analyzing task b1352b0c-aa96-4f58-a0e2-356d3c43c8a1...
-2024-12-14 00:12:20,580 - INFO - number of supporting files: 2
-2024-12-14 00:12:20,580 - INFO - supporting data file UUID: 57793481-c847-4746-8241-ea949add5f87.
-2024-12-14 00:12:20,580 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz.
-2024-12-14 00:12:20,580 - INFO - assuming fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz is an FCIDUMP file.
-2024-12-14 00:12:20,580 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz...
-2024-12-14 00:12:20,585 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:12:21,142 - INFO - Authentication (publickey) successful!
-2024-12-14 00:12:21,157 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:12:30,743 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:46,027 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:12:46,028 - INFO - supporting data file UUID: f6d434e3-5c53-44f3-80ac-da5e7851f45a.
-2024-12-14 00:12:46,028 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h2_cc-pVTZ.f6d434e3-5c53-44f3-80ac-da5e7851f45a.chk.
-2024-12-14 00:12:46,028 - INFO - assuming c2_h2_cc-pVTZ.f6d434e3-5c53-44f3-80ac-da5e7851f45a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:12:46,040 - INFO - parsing ../problem_instances/problem_instance.li_f_0.e48e7467-1fcd-478b-a599-f4ce881c57b9.json
-2024-12-14 00:12:46,040 - INFO - problem_instance UUID: e48e7467-1fcd-478b-a599-f4ce881c57b9
-2024-12-14 00:12:46,040 - INFO - problem_instance short name: li_f_0
-2024-12-14 00:12:46,040 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:12:46,057 - INFO - Analyzing task 80043b93-039c-4d5a-abcb-84b8f25f7abb...
-2024-12-14 00:12:46,057 - INFO - number of supporting files: 2
-2024-12-14 00:12:46,057 - INFO - supporting data file UUID: 19cf5a4d-e90f-4ab1-a062-b20089724a63.
-2024-12-14 00:12:46,057 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz.
-2024-12-14 00:12:46,057 - INFO - assuming fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz is an FCIDUMP file.
-2024-12-14 00:12:46,057 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz...
-2024-12-14 00:12:46,068 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:12:46,698 - INFO - Authentication (publickey) successful!
-2024-12-14 00:12:46,712 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:12:46,802 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:12:47,015 - INFO - ===============================================
-2024-12-14 00:12:47,016 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 294 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 299 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 301 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 304 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 305 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 308 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 309 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 310 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 311 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 312 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 313 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 314 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 320 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 321 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 322 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 323 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 324 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 325 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 326 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:14:15,351 - INFO - Circuit initialization time: 88.335547 seconds.
-2024-12-14 00:14:15,352 - INFO - Estimating logical resources...
-2024-12-14 00:14:28,624 - INFO - Resource estimation time (seconds): 13.272102
-2024-12-14 00:14:28,624 - INFO - supporting data file UUID: e04452b6-2617-4dd7-a493-1d3e5e02639a.
-2024-12-14 00:14:28,624 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVDZ.e04452b6-2617-4dd7-a493-1d3e5e02639a.chk.
-2024-12-14 00:14:28,624 - INFO - assuming li_f_cc-pVDZ.e04452b6-2617-4dd7-a493-1d3e5e02639a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:14:28,624 - INFO - Analyzing task 0485949f-722c-49ee-a748-eec54801f021...
-2024-12-14 00:14:28,624 - INFO - number of supporting files: 2
-2024-12-14 00:14:28,624 - INFO - supporting data file UUID: 2294b211-7a05-445e-810d-4c1706e1444c.
-2024-12-14 00:14:28,624 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz.
-2024-12-14 00:14:28,624 - INFO - assuming fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz is an FCIDUMP file.
-2024-12-14 00:14:28,624 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz...
-2024-12-14 00:14:28,629 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:14:29,148 - INFO - Authentication (publickey) successful!
-2024-12-14 00:14:29,169 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:16:00,079 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:16:44,831 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 00:16:44,832 - INFO - supporting data file UUID: e2d31834-f73d-46a0-ba41-fa67b298611c.
-2024-12-14 00:16:44,832 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVQZ.e2d31834-f73d-46a0-ba41-fa67b298611c.chk.
-2024-12-14 00:16:44,832 - INFO - assuming li_f_cc-pVQZ.e2d31834-f73d-46a0-ba41-fa67b298611c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:16:44,832 - INFO - Analyzing task b80345ff-5df9-4fb3-86ab-0a25188b296d...
-2024-12-14 00:16:44,832 - INFO - number of supporting files: 2
-2024-12-14 00:16:44,832 - INFO - supporting data file UUID: c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.
-2024-12-14 00:16:44,832 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz.
-2024-12-14 00:16:44,832 - INFO - assuming fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz is an FCIDUMP file.
-2024-12-14 00:16:44,832 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz...
-2024-12-14 00:16:44,837 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:16:45,349 - INFO - Authentication (publickey) successful!
-2024-12-14 00:16:45,363 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:16:46,298 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:16:50,126 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 00:16:50,126 - INFO - supporting data file UUID: b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.
-2024-12-14 00:16:50,126 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVTZ.b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.chk.
-2024-12-14 00:16:50,126 - INFO - assuming li_f_cc-pVTZ.b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:16:50,129 - INFO - parsing ../problem_instances/problem_instance.h2_c_o_0.25fd617b-8e7f-4422-9e97-cc3f6b0d3876.json
-2024-12-14 00:16:50,130 - INFO - problem_instance UUID: 25fd617b-8e7f-4422-9e97-cc3f6b0d3876
-2024-12-14 00:16:50,130 - INFO - problem_instance short name: h2_c_o_0
-2024-12-14 00:16:50,130 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:16:50,141 - INFO - Analyzing task d58cb72b-e144-4164-aec0-309aaef6394c...
-2024-12-14 00:16:50,141 - INFO - number of supporting files: 2
-2024-12-14 00:16:50,142 - INFO - supporting data file UUID: d3d8851e-f3df-490c-975a-467933bd9fa1.
-2024-12-14 00:16:50,142 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz.
-2024-12-14 00:16:50,142 - INFO - assuming fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz is an FCIDUMP file.
-2024-12-14 00:16:50,142 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz...
-2024-12-14 00:16:50,149 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:16:50,722 - INFO - Authentication (publickey) successful!
-2024-12-14 00:16:50,741 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:16:50,848 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:16:51,371 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 00:16:51,371 - INFO - supporting data file UUID: 25a78420-0b29-4de5-acdc-104aa0f0b9fb.
-2024-12-14 00:16:51,371 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_c_o_cc-pVDZ.25a78420-0b29-4de5-acdc-104aa0f0b9fb.chk.
-2024-12-14 00:16:51,371 - INFO - assuming h2_c_o_cc-pVDZ.25a78420-0b29-4de5-acdc-104aa0f0b9fb.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:16:51,371 - INFO - Analyzing task ed09e1bf-40f3-4bf0-b9c7-7bb1990c5cae...
-2024-12-14 00:16:51,371 - INFO - number of supporting files: 2
-2024-12-14 00:16:51,371 - INFO - supporting data file UUID: f1c78add-0e23-423a-bb96-f1370626aa47.
-2024-12-14 00:16:51,371 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz.
-2024-12-14 00:16:51,371 - INFO - assuming fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz is an FCIDUMP file.
-2024-12-14 00:16:51,371 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz...
-2024-12-14 00:16:51,376 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:16:52,054 - INFO - Authentication (publickey) successful!
-2024-12-14 00:16:52,071 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:16:58,377 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:17:12,158 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:17:12,159 - INFO - supporting data file UUID: 30bd24e2-947b-4917-89bb-8bdb17406ff5.
-2024-12-14 00:17:12,159 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_c_o_cc-pVTZ.30bd24e2-947b-4917-89bb-8bdb17406ff5.chk.
-2024-12-14 00:17:12,159 - INFO - assuming h2_c_o_cc-pVTZ.30bd24e2-947b-4917-89bb-8bdb17406ff5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:17:12,167 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0011.766ba2da-e72a-4e03-a739-f97269026fc4.json
-2024-12-14 00:17:12,197 - INFO - problem_instance UUID: 766ba2da-e72a-4e03-a739-f97269026fc4
-2024-12-14 00:17:12,198 - INFO - problem_instance short name: planted_solution_0011
-2024-12-14 00:17:12,198 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:17:12,214 - INFO - Analyzing task 0021e256-8e13-42db-839d-e9155e8af82c...
-2024-12-14 00:17:12,214 - INFO - number of supporting files: 1
-2024-12-14 00:17:12,214 - INFO - supporting data file UUID: befcf6f0-cfcb-49b7-b661-de48ad8a44c8.
-2024-12-14 00:17:12,215 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz.
-2024-12-14 00:17:12,215 - INFO - assuming fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz is an FCIDUMP file.
-2024-12-14 00:17:12,215 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz...
-2024-12-14 00:17:12,220 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:17:12,877 - INFO - Authentication (publickey) successful!
-2024-12-14 00:17:12,895 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:17:13,006 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:17:13,368 - INFO - ===============================================
-2024-12-14 00:17:13,369 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 85 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 88 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 90 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 91 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 92 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 93 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 94 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 95 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 96 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 97 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 98 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 99 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 100 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:19:56,940 - INFO - Circuit initialization time: 163.571263 seconds.
-2024-12-14 00:19:56,940 - INFO - Estimating logical resources...
-2024-12-14 00:20:02,010 - INFO - Resource estimation time (seconds): 5.069303
-2024-12-14 00:20:02,012 - INFO - parsing ../problem_instances/problem_instance.Mn_0.bc202949-d76c-4962-b937-5c12b298b8b4.json
-2024-12-14 00:20:02,012 - INFO - problem_instance UUID: bc202949-d76c-4962-b937-5c12b298b8b4
-2024-12-14 00:20:02,012 - INFO - problem_instance short name: Mn_0
-2024-12-14 00:20:02,012 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:20:02,023 - INFO - Analyzing task 289f5dfe-e6d5-48a3-a6ae-25088321d3c6...
-2024-12-14 00:20:02,023 - INFO - number of supporting files: 2
-2024-12-14 00:20:02,023 - INFO - supporting data file UUID: a83413fb-96e3-466e-910b-6d4bab7cdf1d.
-2024-12-14 00:20:02,023 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz.
-2024-12-14 00:20:02,023 - INFO - assuming fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz is an FCIDUMP file.
-2024-12-14 00:20:02,023 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz...
-2024-12-14 00:20:02,029 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:20:02,548 - INFO - Authentication (publickey) successful!
-2024-12-14 00:20:02,561 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:20:03,698 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:20:07,762 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 00:20:07,762 - INFO - supporting data file UUID: da9344cd-a191-40aa-a0bd-726e7200facf.
-2024-12-14 00:20:07,762 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn0_vdz.da9344cd-a191-40aa-a0bd-726e7200facf.chk.
-2024-12-14 00:20:07,762 - INFO - assuming Mn0_vdz.da9344cd-a191-40aa-a0bd-726e7200facf.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:20:07,762 - INFO - Analyzing task 24f12fad-130e-44fc-8b07-bc26c5a3d878...
-2024-12-14 00:20:07,762 - INFO - number of supporting files: 2
-2024-12-14 00:20:07,762 - INFO - supporting data file UUID: 07c9da30-e172-4183-a8af-301628b75f1c.
-2024-12-14 00:20:07,762 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz.
-2024-12-14 00:20:07,762 - INFO - assuming fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz is an FCIDUMP file.
-2024-12-14 00:20:07,763 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz...
-2024-12-14 00:20:07,767 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:20:08,296 - INFO - Authentication (publickey) successful!
-2024-12-14 00:20:08,309 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:21:38,037 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:22:18,500 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:22:18,500 - INFO - supporting data file UUID: 2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.
-2024-12-14 00:22:18,500 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn0_vtz.2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.chk.
-2024-12-14 00:22:18,500 - INFO - assuming Mn0_vtz.2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:22:18,505 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0008.b57eb979-5c09-4974-97b4-5862e109a1ae.json
-2024-12-14 00:22:18,507 - INFO - problem_instance UUID: b57eb979-5c09-4974-97b4-5862e109a1ae
-2024-12-14 00:22:18,507 - INFO - problem_instance short name: planted_solution_0008
-2024-12-14 00:22:18,508 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:22:18,521 - INFO - Analyzing task af56de36-35aa-44b9-8eb7-b9c1e8f7d0f3...
-2024-12-14 00:22:18,522 - INFO - number of supporting files: 1
-2024-12-14 00:22:18,522 - INFO - supporting data file UUID: 44060124-8f2d-4a91-80a9-5a29f0f4f716.
-2024-12-14 00:22:18,522 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz.
-2024-12-14 00:22:18,522 - INFO - assuming fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz is an FCIDUMP file.
-2024-12-14 00:22:18,522 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz...
-2024-12-14 00:22:18,527 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:22:19,074 - INFO - Authentication (publickey) successful!
-2024-12-14 00:22:19,091 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:22:19,154 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:22:19,167 - INFO - ===============================================
-2024-12-14 00:22:19,168 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:22:26,902 - INFO - Circuit initialization time: 7.734096 seconds.
-2024-12-14 00:22:26,902 - INFO - Estimating logical resources...
-2024-12-14 00:22:28,213 - INFO - Resource estimation time (seconds): 1.310624
-2024-12-14 00:22:28,214 - INFO - parsing ../problem_instances/problem_instance.mo_n2.664ec8e4-09d5-41cc-6266-ddb26219366f.json
-2024-12-14 00:22:28,215 - INFO - problem_instance UUID: 664ec8e4-09d5-41cc-6266-ddb26219366f
-2024-12-14 00:22:28,215 - INFO - problem_instance short name: mo_n2
-2024-12-14 00:22:28,215 - INFO - contains 4 associated Hamiltonians.
-2024-12-14 00:22:28,226 - INFO - Analyzing task 00ba4917-d66a-4335-819f-43390dfc9929...
-2024-12-14 00:22:28,226 - INFO - number of supporting files: 1
-2024-12-14 00:22:28,226 - INFO - supporting data file UUID: 23aa47ca-9afe-4086-bd97-75de310e033e.
-2024-12-14 00:22:28,226 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz.
-2024-12-14 00:22:28,226 - INFO - assuming fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz is an FCIDUMP file.
-2024-12-14 00:22:28,226 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz...
-2024-12-14 00:22:28,231 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:22:28,744 - INFO - Authentication (publickey) successful!
-2024-12-14 00:22:28,758 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:22:28,837 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:22:29,143 - INFO - ===============================================
-2024-12-14 00:22:29,143 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:26:09,722 - INFO - Circuit initialization time: 220.578768 seconds.
-2024-12-14 00:26:09,722 - INFO - Estimating logical resources...
-2024-12-14 00:26:40,307 - INFO - Resource estimation time (seconds): 30.584804
-2024-12-14 00:26:40,307 - INFO - Analyzing task b9cc699a-80f8-4280-9731-23dee4d5a6a5...
-2024-12-14 00:26:40,307 - INFO - number of supporting files: 1
-2024-12-14 00:26:40,308 - INFO - supporting data file UUID: e10bd99a-435c-41cd-84f1-41bd67890fc7.
-2024-12-14 00:26:40,308 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz.
-2024-12-14 00:26:40,308 - INFO - assuming fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz is an FCIDUMP file.
-2024-12-14 00:26:40,308 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz...
-2024-12-14 00:26:40,317 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:26:40,841 - INFO - Authentication (publickey) successful!
-2024-12-14 00:26:40,856 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:26:41,146 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:26:42,653 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 00:26:42,653 - INFO - Analyzing task dfd78a05-437d-4667-88d7-7e2a3384b816...
-2024-12-14 00:26:42,653 - INFO - number of supporting files: 1
-2024-12-14 00:26:42,653 - INFO - supporting data file UUID: b71baf3c-d5f0-4f8d-aead-648ba69a058e.
-2024-12-14 00:26:42,653 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz.
-2024-12-14 00:26:42,654 - INFO - assuming fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz is an FCIDUMP file.
-2024-12-14 00:26:42,654 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz...
-2024-12-14 00:26:42,659 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:26:43,168 - INFO - Authentication (publickey) successful!
-2024-12-14 00:26:43,184 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:26:43,422 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:26:44,932 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 00:26:44,932 - INFO - Analyzing task 35c1aee4-4ef3-4e18-bc2a-377cf45e8fa1...
-2024-12-14 00:26:44,932 - INFO - number of supporting files: 1
-2024-12-14 00:26:44,932 - INFO - supporting data file UUID: 77c12db8-c32e-4f88-8552-9762a0fff763.
-2024-12-14 00:26:44,932 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz.
-2024-12-14 00:26:44,932 - INFO - assuming fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz is an FCIDUMP file.
-2024-12-14 00:26:44,932 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz...
-2024-12-14 00:26:44,937 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:26:45,457 - INFO - Authentication (publickey) successful!
-2024-12-14 00:26:45,470 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:26:45,569 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:26:45,900 - INFO - ===============================================
-2024-12-14 00:26:45,900 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:30:00,684 - INFO - Circuit initialization time: 194.784019 seconds.
-2024-12-14 00:30:00,684 - INFO - Estimating logical resources...
-2024-12-14 00:30:30,667 - INFO - Resource estimation time (seconds): 29.982253
-2024-12-14 00:30:30,668 - INFO - parsing ../problem_instances/problem_instance.li_h_0.6d355019-13aa-41fc-a530-31d5f968ba22.json
-2024-12-14 00:30:30,669 - INFO - problem_instance UUID: 6d355019-13aa-41fc-a530-31d5f968ba22
-2024-12-14 00:30:30,669 - INFO - problem_instance short name: li_h_0
-2024-12-14 00:30:30,669 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:30:30,681 - INFO - Analyzing task 92917287-d937-410c-bb70-c1f34224fab7...
-2024-12-14 00:30:30,681 - INFO - number of supporting files: 2
-2024-12-14 00:30:30,681 - INFO - supporting data file UUID: 9c6f0876-5690-4391-a98c-0347d111257e.
-2024-12-14 00:30:30,681 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz.
-2024-12-14 00:30:30,681 - INFO - assuming fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz is an FCIDUMP file.
-2024-12-14 00:30:30,681 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz...
-2024-12-14 00:30:30,686 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:30:31,216 - INFO - Authentication (publickey) successful!
-2024-12-14 00:30:31,232 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:30:31,296 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:30:31,334 - INFO - ===============================================
-2024-12-14 00:30:31,334 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 160 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 165 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 168 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:30:51,765 - INFO - Circuit initialization time: 20.430973 seconds.
-2024-12-14 00:30:51,765 - INFO - Estimating logical resources...
-2024-12-14 00:30:56,328 - INFO - Resource estimation time (seconds): 4.562898
-2024-12-14 00:30:56,329 - INFO - supporting data file UUID: 0be93350-ebd5-4fd0-bbbe-029a7cc7681b.
-2024-12-14 00:30:56,329 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVDZ.0be93350-ebd5-4fd0-bbbe-029a7cc7681b.chk.
-2024-12-14 00:30:56,329 - INFO - assuming li_h_cc-pVDZ.0be93350-ebd5-4fd0-bbbe-029a7cc7681b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:30:56,329 - INFO - Analyzing task 13b4bdcc-1cef-419a-92b1-156febff71d4...
-2024-12-14 00:30:56,329 - INFO - number of supporting files: 2
-2024-12-14 00:30:56,329 - INFO - supporting data file UUID: c21d87dd-9338-4498-8ed6-95b0dacd75b1.
-2024-12-14 00:30:56,329 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz.
-2024-12-14 00:30:56,329 - INFO - assuming fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz is an FCIDUMP file.
-2024-12-14 00:30:56,329 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz...
-2024-12-14 00:30:56,338 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:30:56,894 - INFO - Authentication (publickey) successful!
-2024-12-14 00:30:56,912 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:31:07,650 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:31:23,045 - INFO - Skipping Logical Resource Estimate because number of orbitals (85) exceeds maximum specified in config (32).
-2024-12-14 00:31:23,046 - INFO - supporting data file UUID: 10693a03-698b-416a-80c0-dd563193c1d4.
-2024-12-14 00:31:23,046 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVQZ.10693a03-698b-416a-80c0-dd563193c1d4.chk.
-2024-12-14 00:31:23,046 - INFO - assuming li_h_cc-pVQZ.10693a03-698b-416a-80c0-dd563193c1d4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:31:23,046 - INFO - Analyzing task d15db194-aa2d-4de9-8f86-fcffeb82f38b...
-2024-12-14 00:31:23,046 - INFO - number of supporting files: 2
-2024-12-14 00:31:23,046 - INFO - supporting data file UUID: 02d12f52-ff42-4adf-99b9-acada93cb96b.
-2024-12-14 00:31:23,047 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz.
-2024-12-14 00:31:23,047 - INFO - assuming fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz is an FCIDUMP file.
-2024-12-14 00:31:23,047 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz...
-2024-12-14 00:31:23,052 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:31:23,692 - INFO - Authentication (publickey) successful!
-2024-12-14 00:31:23,709 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:31:23,882 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:31:25,230 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 00:31:25,230 - INFO - supporting data file UUID: 17337d1b-d2a5-4121-bf4a-d7236edd5c05.
-2024-12-14 00:31:25,230 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVTZ.17337d1b-d2a5-4121-bf4a-d7236edd5c05.chk.
-2024-12-14 00:31:25,230 - INFO - assuming li_h_cc-pVTZ.17337d1b-d2a5-4121-bf4a-d7236edd5c05.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:31:25,233 - INFO - parsing ../problem_instances/problem_instance.li2_0.3301a356-21a9-472b-8021-f02f4d2c9eec.json
-2024-12-14 00:31:25,234 - INFO - problem_instance UUID: 3301a356-21a9-472b-8021-f02f4d2c9eec
-2024-12-14 00:31:25,234 - INFO - problem_instance short name: li2_0
-2024-12-14 00:31:25,234 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:31:25,251 - INFO - Analyzing task e7d3b8bd-ff6c-44f6-8a9e-b9b75396cee0...
-2024-12-14 00:31:25,251 - INFO - number of supporting files: 2
-2024-12-14 00:31:25,251 - INFO - supporting data file UUID: 243670ee-2d2e-4d90-abc1-16938a04a80b.
-2024-12-14 00:31:25,252 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz.
-2024-12-14 00:31:25,252 - INFO - assuming fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz is an FCIDUMP file.
-2024-12-14 00:31:25,252 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz...
-2024-12-14 00:31:25,258 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:31:25,902 - INFO - Authentication (publickey) successful!
-2024-12-14 00:31:25,920 - INFO - [chan 0] Opened sftp connection (server version 3)
-Downloading gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz to fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz...
-Parsing fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b
-Downloading gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz to fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz...
-Parsing fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821
-Downloading gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz to fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz...
-Parsing fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8
-Downloading gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz to fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz...
-Parsing fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573
-Downloading gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz to fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz...
-Parsing fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5
-Downloading gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz to fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz...
-Parsing fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459
-Downloading gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz to fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz...
-Parsing fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1
-Downloading gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz to fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz...
-Parsing fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761
-Downloading gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz to fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz...
-Parsing fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9
-Downloading gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz to fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz...
-Parsing fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f
-Downloading gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz to fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz...
-Parsing fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f
-Downloading gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz to fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz...
-Parsing fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154
-Downloading gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz to fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz...
-Parsing fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2
-Downloading gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz to fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz...
-Parsing fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080
-Downloading gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz to fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz...
-Parsing fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72
-Downloading gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz to fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz...
-Parsing fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7
-Downloading gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz to fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz...
-Parsing fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d
-Downloading gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz to fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz...
-Parsing fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f
-Downloading gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz to fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz...
-Parsing fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87
-Downloading gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz to fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz...
-Parsing fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63
-Downloading gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz to fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz...
-Parsing fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c
-Downloading gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz to fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz...
-Parsing fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c
-Downloading gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz to fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz...
-Parsing fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1
-Downloading gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz to fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz...
-Parsing fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47
-Downloading gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz to fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz...
-Parsing fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8
-Downloading gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz to fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz...
-Parsing fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d
-Downloading gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz to fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz...
-Parsing fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c
-Downloading gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz to fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz...
-Parsing fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716
-Downloading gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz to fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz...
-Parsing fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e
-Downloading gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz to fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz...
-Parsing fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7
-Downloading gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz to fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz...
-Parsing fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e
-Downloading gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz to fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz...
-Parsing fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763
-Downloading gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz to fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz...
-Parsing fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e
-Downloading gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz to fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz...
-Parsing fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1
-Downloading gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz to fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz...
-Parsing fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b
-2024-12-14 00:31:26,007 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:31:26,154 - INFO - ===============================================
-2024-12-14 00:31:26,155 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 322 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 323 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 324 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 325 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 327 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 328 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 329 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 330 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 331 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 332 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 333 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 334 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 335 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 336 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 337 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 338 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 339 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 340 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 341 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 342 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 343 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 344 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 345 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 346 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 347 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 348 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 349 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 350 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 00:32:54,234 - INFO - Circuit initialization time: 88.079165 seconds.
-2024-12-14 00:32:54,234 - INFO - Estimating logical resources...
-2024-12-14 00:33:09,745 - INFO - Resource estimation time (seconds): 15.510731
-2024-12-14 00:33:09,746 - INFO - supporting data file UUID: 948cb44e-e229-4be7-ba48-8ee73e042a6a.
-2024-12-14 00:33:09,746 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVDZ.948cb44e-e229-4be7-ba48-8ee73e042a6a.chk.
-2024-12-14 00:33:09,746 - INFO - assuming li2_cc-pVDZ.948cb44e-e229-4be7-ba48-8ee73e042a6a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:33:09,746 - INFO - Analyzing task aaa24a30-ade6-44a6-b6aa-51bf54c31eef...
-2024-12-14 00:33:09,746 - INFO - number of supporting files: 2
-2024-12-14 00:33:09,746 - INFO - supporting data file UUID: 6224abe8-831e-4b52-b8d9-8ebac0a35c2b.
-2024-12-14 00:33:09,746 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz.
-2024-12-14 00:33:09,746 - INFO - assuming fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz is an FCIDUMP file.
-2024-12-14 00:33:09,746 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz...
-2024-12-14 00:33:09,751 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:33:10,387 - INFO - Authentication (publickey) successful!
-2024-12-14 00:33:10,402 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:33:38,412 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:34:07,638 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 00:34:07,638 - INFO - supporting data file UUID: 2c2461b8-9343-4405-a3d5-aadd0a6cdac9.
-2024-12-14 00:34:07,638 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVQZ.2c2461b8-9343-4405-a3d5-aadd0a6cdac9.chk.
-2024-12-14 00:34:07,639 - INFO - assuming li2_cc-pVQZ.2c2461b8-9343-4405-a3d5-aadd0a6cdac9.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:34:07,639 - INFO - Analyzing task 410cd417-988a-4f7f-99ad-93dda7eacdcb...
-2024-12-14 00:34:07,639 - INFO - number of supporting files: 2
-2024-12-14 00:34:07,639 - INFO - supporting data file UUID: 26d2547c-96a4-400d-9528-9987ae6699b2.
-2024-12-14 00:34:07,639 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz.
-2024-12-14 00:34:07,639 - INFO - assuming fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz is an FCIDUMP file.
-2024-12-14 00:34:07,639 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz...
-2024-12-14 00:34:07,645 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:34:08,294 - INFO - Authentication (publickey) successful!
-2024-12-14 00:34:08,311 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:34:08,775 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:34:11,522 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 00:34:11,522 - INFO - supporting data file UUID: e51ca409-0d43-4958-b89d-b0a3906c91d5.
-2024-12-14 00:34:11,522 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVTZ.e51ca409-0d43-4958-b89d-b0a3906c91d5.chk.
-2024-12-14 00:34:11,523 - INFO - assuming li2_cc-pVTZ.e51ca409-0d43-4958-b89d-b0a3906c91d5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:34:11,526 - INFO - parsing ../problem_instances/problem_instance.h_f_0.892e3341-7186-44c6-9a1a-20f270ddc8b8.json
-2024-12-14 00:34:11,526 - INFO - problem_instance UUID: 892e3341-7186-44c6-9a1a-20f270ddc8b8
-2024-12-14 00:34:11,526 - INFO - problem_instance short name: h_f_0
-2024-12-14 00:34:11,526 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:34:11,541 - INFO - Analyzing task b59bd259-4941-4cec-bca5-e2795c35d8e0...
-2024-12-14 00:34:11,541 - INFO - number of supporting files: 2
-2024-12-14 00:34:11,541 - INFO - supporting data file UUID: b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.
-2024-12-14 00:34:11,541 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz.
-2024-12-14 00:34:11,541 - INFO - assuming fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz is an FCIDUMP file.
-2024-12-14 00:34:11,541 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz...
-2024-12-14 00:34:11,546 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:34:12,198 - INFO - Authentication (publickey) successful!
-2024-12-14 00:34:12,215 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:34:12,280 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:34:12,330 - INFO - ===============================================
-2024-12-14 00:34:12,330 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 154 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 163 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 166 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 167 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 168 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 169 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 170 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 171 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:34:35,094 - INFO - Circuit initialization time: 22.76317 seconds.
-2024-12-14 00:34:35,094 - INFO - Estimating logical resources...
-2024-12-14 00:34:40,466 - INFO - Resource estimation time (seconds): 5.371073
-2024-12-14 00:34:40,466 - INFO - supporting data file UUID: 3bb657ac-2131-4ee7-9859-9e4ff876245a.
-2024-12-14 00:34:40,466 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVDZ.3bb657ac-2131-4ee7-9859-9e4ff876245a.chk.
-2024-12-14 00:34:40,467 - INFO - assuming h_f_cc-pVDZ.3bb657ac-2131-4ee7-9859-9e4ff876245a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:34:40,467 - INFO - Analyzing task 9e3c577f-a25d-42f5-a809-61dfb63a52de...
-2024-12-14 00:34:40,467 - INFO - number of supporting files: 2
-2024-12-14 00:34:40,467 - INFO - supporting data file UUID: ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.
-2024-12-14 00:34:40,467 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz.
-2024-12-14 00:34:40,468 - INFO - assuming fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz is an FCIDUMP file.
-2024-12-14 00:34:40,468 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz...
-2024-12-14 00:34:40,473 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:34:41,102 - INFO - Authentication (publickey) successful!
-2024-12-14 00:34:41,116 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:34:52,499 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:35:10,331 - INFO - Skipping Logical Resource Estimate because number of orbitals (85) exceeds maximum specified in config (32).
-2024-12-14 00:35:10,331 - INFO - supporting data file UUID: ddc246a3-9770-4542-8cfd-74afbff4e7a0.
-2024-12-14 00:35:10,331 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVQZ.ddc246a3-9770-4542-8cfd-74afbff4e7a0.chk.
-2024-12-14 00:35:10,331 - INFO - assuming h_f_cc-pVQZ.ddc246a3-9770-4542-8cfd-74afbff4e7a0.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:35:10,331 - INFO - Analyzing task daa86ad6-bda9-4d47-a50d-4ec34801bd82...
-2024-12-14 00:35:10,331 - INFO - number of supporting files: 2
-2024-12-14 00:35:10,331 - INFO - supporting data file UUID: 819ffa8e-51ee-4e78-aa07-17686d7a9488.
-2024-12-14 00:35:10,331 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz.
-2024-12-14 00:35:10,332 - INFO - assuming fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz is an FCIDUMP file.
-2024-12-14 00:35:10,332 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz...
-2024-12-14 00:35:10,337 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:35:10,999 - INFO - Authentication (publickey) successful!
-2024-12-14 00:35:11,014 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:35:11,194 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:35:12,689 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 00:35:12,689 - INFO - supporting data file UUID: 7369a736-b751-4ace-a057-7f6a07194ffa.
-2024-12-14 00:35:12,690 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVTZ.7369a736-b751-4ace-a057-7f6a07194ffa.chk.
-2024-12-14 00:35:12,690 - INFO - assuming h_f_cc-pVTZ.7369a736-b751-4ace-a057-7f6a07194ffa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:35:12,692 - INFO - parsing ../problem_instances/problem_instance.Fe_0.05abb33d-ecea-406f-8832-31a814b26dfd.json
-2024-12-14 00:35:12,692 - INFO - problem_instance UUID: 05abb33d-ecea-406f-8832-31a814b26dfd
-2024-12-14 00:35:12,693 - INFO - problem_instance short name: Fe_0
-2024-12-14 00:35:12,693 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:35:12,708 - INFO - Analyzing task 5b8f4746-a08b-4ec5-92e2-ce55cc2fdb75...
-2024-12-14 00:35:12,708 - INFO - number of supporting files: 2
-2024-12-14 00:35:12,708 - INFO - supporting data file UUID: 133ec573-3d06-4582-b2f5-8afe8be8dbe3.
-2024-12-14 00:35:12,708 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz.
-2024-12-14 00:35:12,709 - INFO - assuming fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz is an FCIDUMP file.
-2024-12-14 00:35:12,709 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz...
-2024-12-14 00:35:12,715 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:35:13,364 - INFO - Authentication (publickey) successful!
-2024-12-14 00:35:13,386 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:35:15,474 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:35:22,727 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 00:35:22,727 - INFO - supporting data file UUID: 6644ed13-743e-4f98-8ab9-6c2abf88d032.
-2024-12-14 00:35:22,727 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe0_vdz.6644ed13-743e-4f98-8ab9-6c2abf88d032.chk.
-2024-12-14 00:35:22,727 - INFO - assuming Fe0_vdz.6644ed13-743e-4f98-8ab9-6c2abf88d032.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:35:22,728 - INFO - Analyzing task c63f5f9b-ee73-4887-949b-dd1e74c31874...
-2024-12-14 00:35:22,728 - INFO - number of supporting files: 2
-2024-12-14 00:35:22,728 - INFO - supporting data file UUID: cb274492-6acb-4426-a4f6-8cb4a8cef3c5.
-2024-12-14 00:35:22,728 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz.
-2024-12-14 00:35:22,728 - INFO - assuming fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz is an FCIDUMP file.
-2024-12-14 00:35:22,728 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz...
-2024-12-14 00:35:22,735 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:35:23,361 - INFO - Authentication (publickey) successful!
-2024-12-14 00:35:23,378 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:36:55,164 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:37:45,799 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:37:45,799 - INFO - supporting data file UUID: 9d520d39-2e21-4294-8d58-af6d068b38de.
-2024-12-14 00:37:45,799 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe0_vtz.9d520d39-2e21-4294-8d58-af6d068b38de.chk.
-2024-12-14 00:37:45,799 - INFO - assuming Fe0_vtz.9d520d39-2e21-4294-8d58-af6d068b38de.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:37:45,811 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0010.bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8.json
-2024-12-14 00:37:45,842 - INFO - problem_instance UUID: bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8
-2024-12-14 00:37:45,843 - INFO - problem_instance short name: planted_solution_0010
-2024-12-14 00:37:45,843 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:37:45,867 - INFO - Analyzing task 7cc1ed5c-0dcb-4315-9e51-2ae94b5cdd02...
-2024-12-14 00:37:45,867 - INFO - number of supporting files: 1
-2024-12-14 00:37:45,867 - INFO - supporting data file UUID: eea867d0-285e-462d-94ab-15579c782be7.
-2024-12-14 00:37:45,867 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz.
-2024-12-14 00:37:45,867 - INFO - assuming fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz is an FCIDUMP file.
-2024-12-14 00:37:45,867 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz...
-2024-12-14 00:37:45,873 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:37:46,505 - INFO - Authentication (publickey) successful!
-2024-12-14 00:37:46,521 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:37:46,611 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:37:46,907 - INFO - ===============================================
-2024-12-14 00:37:46,907 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 91 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 93 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 94 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 95 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 96 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 97 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 98 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 99 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 100 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:40:39,359 - INFO - Circuit initialization time: 172.451545 seconds.
-2024-12-14 00:40:39,359 - INFO - Estimating logical resources...
-2024-12-14 00:40:45,445 - INFO - Resource estimation time (seconds): 6.085192
-2024-12-14 00:40:45,448 - INFO - parsing ../problem_instances/problem_instance.ru_macho.b78a10f2-ce8a-43c0-69ec-4cf666d8e85c.json
-2024-12-14 00:40:45,449 - INFO - problem_instance UUID: b78a10f2-ce8a-43c0-69ec-4cf666d8e85c
-2024-12-14 00:40:45,449 - INFO - problem_instance short name: ru_macho
-2024-12-14 00:40:45,449 - INFO - contains 9 associated Hamiltonians.
-2024-12-14 00:40:45,466 - INFO - Analyzing task 4357d5bb-ed2b-466a-947b-e868afb81d3d...
-2024-12-14 00:40:45,467 - INFO - number of supporting files: 1
-2024-12-14 00:40:45,467 - INFO - supporting data file UUID: 1dc29784-ab7f-45a1-9821-31fea4363d74.
-2024-12-14 00:40:45,467 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz.
-2024-12-14 00:40:45,467 - INFO - assuming fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz is an FCIDUMP file.
-2024-12-14 00:40:45,467 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz...
-2024-12-14 00:40:45,473 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:40:46,131 - INFO - Authentication (publickey) successful!
-2024-12-14 00:40:46,147 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:40:46,420 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:40:46,423 - INFO - ===============================================
-2024-12-14 00:40:46,423 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:40:48,170 - INFO - Circuit initialization time: 1.745921 seconds.
-2024-12-14 00:40:48,170 - INFO - Estimating logical resources...
-2024-12-14 00:40:48,734 - INFO - Resource estimation time (seconds): 0.563967
-2024-12-14 00:40:48,735 - INFO - Analyzing task b164af91-a758-445c-8e78-610ffd2ad795...
-2024-12-14 00:40:48,735 - INFO - number of supporting files: 1
-2024-12-14 00:40:48,735 - INFO - supporting data file UUID: 5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.
-2024-12-14 00:40:48,735 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz.
-2024-12-14 00:40:48,736 - INFO - assuming fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz is an FCIDUMP file.
-2024-12-14 00:40:48,736 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz...
-2024-12-14 00:40:48,741 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:40:49,389 - INFO - Authentication (publickey) successful!
-2024-12-14 00:40:49,410 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:40:49,460 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:40:49,465 - INFO - ===============================================
-2024-12-14 00:40:49,465 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:40:52,730 - INFO - Circuit initialization time: 3.264664 seconds.
-2024-12-14 00:40:52,730 - INFO - Estimating logical resources...
-2024-12-14 00:40:53,973 - INFO - Resource estimation time (seconds): 1.242734
-2024-12-14 00:40:53,974 - INFO - Analyzing task 28bd4997-c04c-4914-9984-0101713041fe...
-2024-12-14 00:40:53,974 - INFO - number of supporting files: 1
-2024-12-14 00:40:53,974 - INFO - supporting data file UUID: 587f69a8-4295-4d6d-811e-0eacfbc5f6dd.
-2024-12-14 00:40:53,974 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz.
-2024-12-14 00:40:53,974 - INFO - assuming fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz is an FCIDUMP file.
-2024-12-14 00:40:53,975 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz...
-2024-12-14 00:40:53,980 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:40:54,677 - INFO - Authentication (publickey) successful!
-2024-12-14 00:40:54,692 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:40:54,749 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:40:54,767 - INFO - ===============================================
-2024-12-14 00:40:54,768 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:41:06,867 - INFO - Circuit initialization time: 12.099072 seconds.
-2024-12-14 00:41:06,867 - INFO - Estimating logical resources...
-2024-12-14 00:41:10,306 - INFO - Resource estimation time (seconds): 3.438362
-2024-12-14 00:41:10,306 - INFO - Analyzing task dcf2b441-b297-4a89-ae18-5778ec2d674d...
-2024-12-14 00:41:10,306 - INFO - number of supporting files: 1
-2024-12-14 00:41:10,306 - INFO - supporting data file UUID: 46aea10c-d57f-4133-9837-3c57d474d9a2.
-2024-12-14 00:41:10,306 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz.
-2024-12-14 00:41:10,306 - INFO - assuming fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz is an FCIDUMP file.
-2024-12-14 00:41:10,306 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz...
-2024-12-14 00:41:10,312 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:41:10,968 - INFO - Authentication (publickey) successful!
-2024-12-14 00:41:10,983 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:41:11,039 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:41:11,050 - INFO - ===============================================
-2024-12-14 00:41:11,050 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:41:18,246 - INFO - Circuit initialization time: 7.195597 seconds.
-2024-12-14 00:41:18,246 - INFO - Estimating logical resources...
-2024-12-14 00:41:20,332 - INFO - Resource estimation time (seconds): 2.085523
-2024-12-14 00:41:20,332 - INFO - Analyzing task 6346b7fe-a4a5-4b10-a79b-706d4339923e...
-2024-12-14 00:41:20,332 - INFO - number of supporting files: 1
-2024-12-14 00:41:20,332 - INFO - supporting data file UUID: 496aaf89-2cdf-43cf-8b25-246e915cc8b5.
-2024-12-14 00:41:20,332 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz.
-2024-12-14 00:41:20,332 - INFO - assuming fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz is an FCIDUMP file.
-2024-12-14 00:41:20,332 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz...
-2024-12-14 00:41:20,337 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:41:20,986 - INFO - Authentication (publickey) successful!
-2024-12-14 00:41:21,002 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:41:21,100 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:41:21,608 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 00:41:21,608 - INFO - Analyzing task 68db6781-dd54-43c4-b667-7b754c4d5cdb...
-2024-12-14 00:41:21,608 - INFO - number of supporting files: 1
-2024-12-14 00:41:21,608 - INFO - supporting data file UUID: 0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.
-2024-12-14 00:41:21,608 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz.
-2024-12-14 00:41:21,609 - INFO - assuming fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz is an FCIDUMP file.
-2024-12-14 00:41:21,609 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz...
-2024-12-14 00:41:21,614 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:41:22,282 - INFO - Authentication (publickey) successful!
-2024-12-14 00:41:22,296 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:41:22,369 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:41:22,491 - INFO - ===============================================
-2024-12-14 00:41:22,491 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:42:42,735 - INFO - Circuit initialization time: 80.243604 seconds.
-2024-12-14 00:42:42,735 - INFO - Estimating logical resources...
-2024-12-14 00:42:56,304 - INFO - Resource estimation time (seconds): 13.569326
-2024-12-14 00:42:56,305 - INFO - Analyzing task d3ecd428-ee03-4d8b-aa14-af4d935781ed...
-2024-12-14 00:42:56,305 - INFO - number of supporting files: 1
-2024-12-14 00:42:56,305 - INFO - supporting data file UUID: e5e63f77-dbaa-431c-a53f-93c0f4c0758d.
-2024-12-14 00:42:56,305 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz.
-2024-12-14 00:42:56,305 - INFO - assuming fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz is an FCIDUMP file.
-2024-12-14 00:42:56,305 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz...
-2024-12-14 00:42:56,311 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:42:56,820 - INFO - Authentication (publickey) successful!
-2024-12-14 00:42:56,833 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:42:57,103 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:42:58,967 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 00:42:58,967 - INFO - Analyzing task 89253c8f-0f01-4046-a138-1bada22f0a6a...
-2024-12-14 00:42:58,967 - INFO - number of supporting files: 1
-2024-12-14 00:42:58,967 - INFO - supporting data file UUID: d7bea809-6e34-49f8-8daf-8d728dd18268.
-2024-12-14 00:42:58,967 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz.
-2024-12-14 00:42:58,967 - INFO - assuming fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz is an FCIDUMP file.
-2024-12-14 00:42:58,967 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz...
-2024-12-14 00:42:58,975 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:42:59,625 - INFO - Authentication (publickey) successful!
-2024-12-14 00:42:59,640 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:42:59,706 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:42:59,796 - INFO - ===============================================
-2024-12-14 00:42:59,796 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:43:53,684 - INFO - Circuit initialization time: 53.888095 seconds.
-2024-12-14 00:43:53,684 - INFO - Estimating logical resources...
-2024-12-14 00:44:04,036 - INFO - Resource estimation time (seconds): 10.351246
-2024-12-14 00:44:04,036 - INFO - Analyzing task 842d2152-2f91-4dce-b088-7ed26afb2381...
-2024-12-14 00:44:04,036 - INFO - number of supporting files: 1
-2024-12-14 00:44:04,036 - INFO - supporting data file UUID: 73ae455f-a729-4fac-a626-5654b03c1ef5.
-2024-12-14 00:44:04,036 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz.
-2024-12-14 00:44:04,036 - INFO - assuming fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz is an FCIDUMP file.
-2024-12-14 00:44:04,036 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz...
-2024-12-14 00:44:04,041 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:44:04,691 - INFO - Authentication (publickey) successful!
-2024-12-14 00:44:04,710 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:44:04,922 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:44:06,274 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 00:44:06,276 - INFO - parsing ../problem_instances/problem_instance.Cu_1.d5c7ab73-dfc1-499e-9027-601476004107.json
-2024-12-14 00:44:06,276 - INFO - problem_instance UUID: d5c7ab73-dfc1-499e-9027-601476004107
-2024-12-14 00:44:06,276 - INFO - problem_instance short name: Cu_1
-2024-12-14 00:44:06,276 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:44:06,291 - INFO - Analyzing task 5f5fee92-5821-4d38-a54a-d204660f205f...
-2024-12-14 00:44:06,291 - INFO - number of supporting files: 2
-2024-12-14 00:44:06,291 - INFO - supporting data file UUID: 6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.
-2024-12-14 00:44:06,291 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz.
-2024-12-14 00:44:06,291 - INFO - assuming fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz is an FCIDUMP file.
-2024-12-14 00:44:06,291 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz...
-2024-12-14 00:44:06,300 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:44:06,938 - INFO - Authentication (publickey) successful!
-2024-12-14 00:44:06,960 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:44:07,641 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:44:11,251 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 00:44:11,252 - INFO - supporting data file UUID: 36737c9f-2f69-4963-91a1-daf7a2a3fcfd.
-2024-12-14 00:44:11,252 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu1_vdz.36737c9f-2f69-4963-91a1-daf7a2a3fcfd.chk.
-2024-12-14 00:44:11,252 - INFO - assuming Cu1_vdz.36737c9f-2f69-4963-91a1-daf7a2a3fcfd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:44:11,252 - INFO - Analyzing task 1c7f5399-8982-4daf-81a5-7cef4e4588cc...
-2024-12-14 00:44:11,252 - INFO - number of supporting files: 2
-2024-12-14 00:44:11,252 - INFO - supporting data file UUID: 68952c71-d281-40fa-bcd2-cb0352f70a89.
-2024-12-14 00:44:11,252 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz.
-2024-12-14 00:44:11,252 - INFO - assuming fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz is an FCIDUMP file.
-2024-12-14 00:44:11,252 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz...
-2024-12-14 00:44:11,257 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:44:11,744 - INFO - Authentication (publickey) successful!
-2024-12-14 00:44:11,760 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:44:35,185 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:44:59,793 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 00:44:59,793 - INFO - supporting data file UUID: d9bbc858-2cef-43ee-896f-c9059d2b13b5.
-2024-12-14 00:44:59,793 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu1_vtz.d9bbc858-2cef-43ee-896f-c9059d2b13b5.chk.
-2024-12-14 00:44:59,793 - INFO - assuming Cu1_vtz.d9bbc858-2cef-43ee-896f-c9059d2b13b5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:44:59,795 - INFO - parsing ../problem_instances/problem_instance.n_h3_0.127cfea5-8a7d-45a0-9012-949816a0b8d9.json
-2024-12-14 00:44:59,795 - INFO - problem_instance UUID: 127cfea5-8a7d-45a0-9012-949816a0b8d9
-2024-12-14 00:44:59,795 - INFO - problem_instance short name: n_h3_0
-2024-12-14 00:44:59,795 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:44:59,810 - INFO - Analyzing task 77c3a92c-066c-4043-a4a1-5e8324014d0b...
-2024-12-14 00:44:59,810 - INFO - number of supporting files: 2
-2024-12-14 00:44:59,810 - INFO - supporting data file UUID: 9820e181-088a-4b00-8a14-8cafb952ccdd.
-2024-12-14 00:44:59,810 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz.
-2024-12-14 00:44:59,810 - INFO - assuming fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz is an FCIDUMP file.
-2024-12-14 00:44:59,811 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz...
-2024-12-14 00:44:59,821 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:45:00,533 - INFO - Authentication (publickey) successful!
-2024-12-14 00:45:00,565 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:45:00,765 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:45:01,339 - INFO - ===============================================
-2024-12-14 00:45:01,339 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 367 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 368 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 369 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 371 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 372 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 373 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:47:56,022 - INFO - Circuit initialization time: 174.682485 seconds.
-2024-12-14 00:47:56,022 - INFO - Estimating logical resources...
-2024-12-14 00:48:22,357 - INFO - Resource estimation time (seconds): 26.335105
-2024-12-14 00:48:22,358 - INFO - supporting data file UUID: e3cda046-ae0d-47d9-b012-7f1e5f632f71.
-2024-12-14 00:48:22,358 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n_h3_cc-pVDZ.e3cda046-ae0d-47d9-b012-7f1e5f632f71.chk.
-2024-12-14 00:48:22,358 - INFO - assuming n_h3_cc-pVDZ.e3cda046-ae0d-47d9-b012-7f1e5f632f71.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:48:22,358 - INFO - Analyzing task 1094e868-f84e-403b-9b54-50802b1cdb60...
-2024-12-14 00:48:22,358 - INFO - number of supporting files: 2
-2024-12-14 00:48:22,358 - INFO - supporting data file UUID: 3b423f54-aa64-4331-a59b-d6c37de1fbb6.
-2024-12-14 00:48:22,358 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz.
-2024-12-14 00:48:22,358 - INFO - assuming fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz is an FCIDUMP file.
-2024-12-14 00:48:22,358 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz...
-2024-12-14 00:48:22,363 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:48:23,031 - INFO - Authentication (publickey) successful!
-2024-12-14 00:48:23,047 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:48:40,730 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:49:02,710 - INFO - Skipping Logical Resource Estimate because number of orbitals (72) exceeds maximum specified in config (32).
-2024-12-14 00:49:02,710 - INFO - supporting data file UUID: 15125674-abf8-4db2-9db6-9d293b677584.
-2024-12-14 00:49:02,710 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n_h3_cc-pVTZ.15125674-abf8-4db2-9db6-9d293b677584.chk.
-2024-12-14 00:49:02,710 - INFO - assuming n_h3_cc-pVTZ.15125674-abf8-4db2-9db6-9d293b677584.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:49:02,712 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0006.42958a3e-8b35-4992-acd8-6711848066c1.json
-2024-12-14 00:49:02,751 - INFO - problem_instance UUID: 42958a3e-8b35-4992-acd8-6711848066c1
-2024-12-14 00:49:02,751 - INFO - problem_instance short name: planted_solution_0006
-2024-12-14 00:49:02,752 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:49:02,767 - INFO - Analyzing task d28f02ba-d43f-4df9-a01a-f1e8ac326e08...
-2024-12-14 00:49:02,767 - INFO - number of supporting files: 1
-2024-12-14 00:49:02,767 - INFO - supporting data file UUID: a4b9a6bd-4479-44b2-b172-642f74396781.
-2024-12-14 00:49:02,767 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz.
-2024-12-14 00:49:02,767 - INFO - assuming fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz is an FCIDUMP file.
-2024-12-14 00:49:02,767 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz...
-2024-12-14 00:49:02,775 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:49:03,429 - INFO - Authentication (publickey) successful!
-2024-12-14 00:49:03,445 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:49:03,504 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:49:03,526 - INFO - ===============================================
-2024-12-14 00:49:03,526 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:49:13,176 - INFO - Circuit initialization time: 9.650329 seconds.
-2024-12-14 00:49:13,176 - INFO - Estimating logical resources...
-2024-12-14 00:49:14,745 - INFO - Resource estimation time (seconds): 1.568107
-2024-12-14 00:49:14,747 - INFO - parsing ../problem_instances/problem_instance.n2_h4_0.f1a6b508-75e8-4afb-9c81-fc61af11b523.json
-2024-12-14 00:49:14,747 - INFO - problem_instance UUID: f1a6b508-75e8-4afb-9c81-fc61af11b523
-2024-12-14 00:49:14,747 - INFO - problem_instance short name: n2_h4_0
-2024-12-14 00:49:14,747 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 00:49:14,761 - INFO - Analyzing task 828c931b-4d5a-486e-ba26-abb293c1ccef...
-2024-12-14 00:49:14,761 - INFO - number of supporting files: 2
-2024-12-14 00:49:14,761 - INFO - supporting data file UUID: aba33661-3ce8-4f28-824f-e98244906d94.
-2024-12-14 00:49:14,762 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz.
-2024-12-14 00:49:14,762 - INFO - assuming fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz is an FCIDUMP file.
-2024-12-14 00:49:14,762 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz...
-2024-12-14 00:49:14,767 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:49:15,415 - INFO - Authentication (publickey) successful!
-2024-12-14 00:49:15,434 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:49:16,864 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:49:21,418 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 00:49:21,418 - INFO - supporting data file UUID: 93193d14-3f99-4495-bcf8-e60f9d863904.
-2024-12-14 00:49:21,418 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_h4_cc-pVDZ.93193d14-3f99-4495-bcf8-e60f9d863904.chk.
-2024-12-14 00:49:21,418 - INFO - assuming n2_h4_cc-pVDZ.93193d14-3f99-4495-bcf8-e60f9d863904.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:49:21,420 - INFO - parsing ../problem_instances/problem_instance.c2_h4_0.9fbd9b4c-5ea9-4095-af7b-7d4491399e42.json
-2024-12-14 00:49:21,420 - INFO - problem_instance UUID: 9fbd9b4c-5ea9-4095-af7b-7d4491399e42
-2024-12-14 00:49:21,420 - INFO - problem_instance short name: c2_h4_0
-2024-12-14 00:49:21,420 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 00:49:21,434 - INFO - Analyzing task 26423f2e-e3e1-4bbb-b2ff-52bdae87d65b...
-2024-12-14 00:49:21,435 - INFO - number of supporting files: 2
-2024-12-14 00:49:21,435 - INFO - supporting data file UUID: 40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.
-2024-12-14 00:49:21,435 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz.
-2024-12-14 00:49:21,435 - INFO - assuming fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz is an FCIDUMP file.
-2024-12-14 00:49:21,435 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz...
-2024-12-14 00:49:21,440 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:49:22,092 - INFO - Authentication (publickey) successful!
-2024-12-14 00:49:22,107 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:49:22,315 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:49:23,812 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 00:49:23,812 - INFO - supporting data file UUID: f563c847-e680-4452-8320-aa3b4e8aa3b7.
-2024-12-14 00:49:23,812 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h4_cc-pVDZ.f563c847-e680-4452-8320-aa3b4e8aa3b7.chk.
-2024-12-14 00:49:23,812 - INFO - assuming c2_h4_cc-pVDZ.f563c847-e680-4452-8320-aa3b4e8aa3b7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:49:23,812 - INFO - Analyzing task 9757b7c2-d420-4ebb-8da7-38238951a5ca...
-2024-12-14 00:49:23,812 - INFO - number of supporting files: 2
-2024-12-14 00:49:23,812 - INFO - supporting data file UUID: 4bd40563-25e1-4334-bf15-3ccd36c05ab2.
-2024-12-14 00:49:23,812 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz.
-2024-12-14 00:49:23,812 - INFO - assuming fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz is an FCIDUMP file.
-2024-12-14 00:49:23,812 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz...
-2024-12-14 00:49:23,818 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:49:24,543 - INFO - Authentication (publickey) successful!
-2024-12-14 00:49:24,558 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:50:41,063 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:51:23,354 - INFO - Skipping Logical Resource Estimate because number of orbitals (116) exceeds maximum specified in config (32).
-2024-12-14 00:51:23,354 - INFO - supporting data file UUID: d4db7859-f494-41d7-8658-56dcb50831b4.
-2024-12-14 00:51:23,354 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h4_cc-pVTZ.d4db7859-f494-41d7-8658-56dcb50831b4.chk.
-2024-12-14 00:51:23,354 - INFO - assuming c2_h4_cc-pVTZ.d4db7859-f494-41d7-8658-56dcb50831b4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:51:23,373 - INFO - parsing ../problem_instances/problem_instance.O_1.d712afaf-6ec4-42d9-b5fd-1edee3ec1046.json
-2024-12-14 00:51:23,374 - INFO - problem_instance UUID: d712afaf-6ec4-42d9-b5fd-1edee3ec1046
-2024-12-14 00:51:23,374 - INFO - problem_instance short name: O_1
-2024-12-14 00:51:23,374 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 00:51:23,390 - INFO - Analyzing task 752966e5-7de7-4506-82ae-6b22cd54b1c1...
-2024-12-14 00:51:23,390 - INFO - number of supporting files: 2
-2024-12-14 00:51:23,390 - INFO - supporting data file UUID: 0767fb16-25bd-4f1c-b134-6b536191b36e.
-2024-12-14 00:51:23,390 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz.
-2024-12-14 00:51:23,390 - INFO - assuming fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz is an FCIDUMP file.
-2024-12-14 00:51:23,390 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz...
-2024-12-14 00:51:23,395 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:51:23,933 - INFO - Authentication (publickey) successful!
-2024-12-14 00:51:23,949 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:51:24,028 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:51:24,134 - INFO - ===============================================
-2024-12-14 00:51:24,135 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 175 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 181 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 182 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 183 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 184 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 186 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 187 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 188 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 189 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 190 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 191 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 192 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 193 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 194 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 195 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 196 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 197 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 198 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 199 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 200 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 201 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 202 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:52:05,101 - INFO - Circuit initialization time: 40.966688 seconds.
-2024-12-14 00:52:05,102 - INFO - Estimating logical resources...
-2024-12-14 00:52:13,045 - INFO - Resource estimation time (seconds): 7.942973
-2024-12-14 00:52:13,045 - INFO - supporting data file UUID: db942588-339b-4fb6-a293-f853ebb812d7.
-2024-12-14 00:52:13,045 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vdz.db942588-339b-4fb6-a293-f853ebb812d7.chk.
-2024-12-14 00:52:13,045 - INFO - assuming O1_vdz.db942588-339b-4fb6-a293-f853ebb812d7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:52:13,045 - INFO - Analyzing task 64122cc6-e1bb-4c11-8d00-2189d27194f1...
-2024-12-14 00:52:13,045 - INFO - number of supporting files: 2
-2024-12-14 00:52:13,045 - INFO - supporting data file UUID: 3b587c2c-9579-4c7b-8b3f-e00c69c42981.
-2024-12-14 00:52:13,045 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz.
-2024-12-14 00:52:13,045 - INFO - assuming fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz is an FCIDUMP file.
-2024-12-14 00:52:13,045 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz...
-2024-12-14 00:52:13,051 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:52:13,557 - INFO - Authentication (publickey) successful!
-2024-12-14 00:52:13,572 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:52:22,378 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:52:36,905 - INFO - Skipping Logical Resource Estimate because number of orbitals (79) exceeds maximum specified in config (32).
-2024-12-14 00:52:36,905 - INFO - supporting data file UUID: 9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.
-2024-12-14 00:52:36,905 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vqz.9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.chk.
-2024-12-14 00:52:36,905 - INFO - assuming O1_vqz.9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:52:36,905 - INFO - Analyzing task f9bdbb3b-91b6-43f3-93ca-bef1e10d3835...
-2024-12-14 00:52:36,905 - INFO - number of supporting files: 2
-2024-12-14 00:52:36,905 - INFO - supporting data file UUID: ee1c9912-bca9-42fa-a90d-421e9a26c785.
-2024-12-14 00:52:36,905 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz.
-2024-12-14 00:52:36,906 - INFO - assuming fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz is an FCIDUMP file.
-2024-12-14 00:52:36,906 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz...
-2024-12-14 00:52:36,910 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:52:37,549 - INFO - Authentication (publickey) successful!
-2024-12-14 00:52:37,566 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:52:37,819 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:52:39,353 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 00:52:39,353 - INFO - supporting data file UUID: b295de3f-c1ac-42ed-baf4-97cc52e0dba2.
-2024-12-14 00:52:39,353 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vtz.b295de3f-c1ac-42ed-baf4-97cc52e0dba2.chk.
-2024-12-14 00:52:39,353 - INFO - assuming O1_vtz.b295de3f-c1ac-42ed-baf4-97cc52e0dba2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 00:52:39,355 - INFO - parsing ../problem_instances/problem_instance.cr_dimer.8ed1a800-a4c6-4bff-a6de-cb220554c42f.json
-2024-12-14 00:52:39,355 - INFO - problem_instance UUID: 8ed1a800-a4c6-4bff-a6de-cb220554c42f
-2024-12-14 00:52:39,355 - INFO - problem_instance short name: cr_dimer
-2024-12-14 00:52:39,355 - INFO - contains 12 associated Hamiltonians.
-2024-12-14 00:52:39,366 - INFO - Analyzing task 9030e9c9-0323-413c-a98e-aba16b180ba7...
-2024-12-14 00:52:39,366 - INFO - number of supporting files: 1
-2024-12-14 00:52:39,366 - INFO - supporting data file UUID: 3092dd74-660d-4c7a-9d43-16d1436e084b.
-2024-12-14 00:52:39,366 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz.
-2024-12-14 00:52:39,366 - INFO - assuming FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz is an FCIDUMP file.
-2024-12-14 00:52:39,366 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz...
-2024-12-14 00:52:39,371 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:52:40,071 - INFO - Authentication (publickey) successful!
-2024-12-14 00:52:40,088 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:52:40,154 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:52:40,205 - INFO - ===============================================
-2024-12-14 00:52:40,205 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 00:52:57,842 - INFO - Circuit initialization time: 17.636325 seconds.
-2024-12-14 00:52:57,842 - INFO - Estimating logical resources...
-2024-12-14 00:53:02,767 - INFO - Resource estimation time (seconds): 4.924692
-2024-12-14 00:53:02,767 - INFO - Analyzing task c7c653b0-4440-4a36-a66b-8b81a9a351c7...
-2024-12-14 00:53:02,767 - INFO - number of supporting files: 1
-2024-12-14 00:53:02,767 - INFO - supporting data file UUID: 96843098-e69d-4d1f-8a88-5b24826f7390.
-2024-12-14 00:53:02,767 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz.
-2024-12-14 00:53:02,767 - INFO - assuming FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz is an FCIDUMP file.
-2024-12-14 00:53:02,767 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz...
-2024-12-14 00:53:02,772 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:53:03,432 - INFO - Authentication (publickey) successful!
-2024-12-14 00:53:03,448 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:53:03,513 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:53:03,711 - INFO - ===============================================
-2024-12-14 00:53:03,711 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 00:54:15,344 - INFO - Circuit initialization time: 71.633235 seconds.
-2024-12-14 00:54:15,344 - INFO - Estimating logical resources...
-2024-12-14 00:54:30,067 - INFO - Resource estimation time (seconds): 14.722011
-2024-12-14 00:54:30,067 - INFO - Analyzing task 82f35801-6276-4090-a9aa-b821d94708d4...
-2024-12-14 00:54:30,067 - INFO - number of supporting files: 1
-2024-12-14 00:54:30,067 - INFO - supporting data file UUID: 673dfe91-d90e-4ecd-8560-d6d74de11070.
-2024-12-14 00:54:30,067 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz.
-2024-12-14 00:54:30,067 - INFO - assuming FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz is an FCIDUMP file.
-2024-12-14 00:54:30,067 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz...
-2024-12-14 00:54:30,072 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:54:30,712 - INFO - Authentication (publickey) successful!
-2024-12-14 00:54:30,728 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:54:33,942 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:54:43,390 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 00:54:43,391 - INFO - Analyzing task 362386c9-f0c2-483e-a64d-52208ab9bbc1...
-2024-12-14 00:54:43,391 - INFO - number of supporting files: 1
-2024-12-14 00:54:43,391 - INFO - supporting data file UUID: 4412b7d6-86db-4616-9dd2-2c32ee02560f.
-2024-12-14 00:54:43,391 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz.
-2024-12-14 00:54:43,391 - INFO - assuming FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz is an FCIDUMP file.
-2024-12-14 00:54:43,391 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz...
-2024-12-14 00:54:43,399 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:54:43,927 - INFO - Authentication (publickey) successful!
-2024-12-14 00:54:43,939 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:54:51,456 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:55:04,782 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 00:55:04,782 - INFO - Analyzing task 61ad4cfe-b057-4dd8-bd06-ed56347745c1...
-2024-12-14 00:55:04,782 - INFO - number of supporting files: 1
-2024-12-14 00:55:04,782 - INFO - supporting data file UUID: cdf017c4-7c30-4274-9567-f5e55a6ba857.
-2024-12-14 00:55:04,782 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz.
-2024-12-14 00:55:04,782 - INFO - assuming FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz is an FCIDUMP file.
-2024-12-14 00:55:04,782 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz...
-2024-12-14 00:55:04,790 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:55:05,333 - INFO - Authentication (publickey) successful!
-2024-12-14 00:55:05,346 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:55:05,397 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:55:05,448 - INFO - ===============================================
-2024-12-14 00:55:05,448 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 00:55:25,898 - INFO - Circuit initialization time: 20.449708 seconds.
-2024-12-14 00:55:25,898 - INFO - Estimating logical resources...
-2024-12-14 00:55:30,498 - INFO - Resource estimation time (seconds): 4.599987
-2024-12-14 00:55:30,498 - INFO - Analyzing task fc25a232-d249-4e1c-a9ec-360cab33f779...
-2024-12-14 00:55:30,499 - INFO - number of supporting files: 1
-2024-12-14 00:55:30,499 - INFO - supporting data file UUID: d9341cde-90e8-4d1e-beb2-4e40246d31ce.
-2024-12-14 00:55:30,499 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz.
-2024-12-14 00:55:30,499 - INFO - assuming FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz is an FCIDUMP file.
-2024-12-14 00:55:30,499 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz...
-2024-12-14 00:55:30,504 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:55:31,049 - INFO - Authentication (publickey) successful!
-2024-12-14 00:55:31,067 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:55:31,128 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:55:31,348 - INFO - ===============================================
-2024-12-14 00:55:31,348 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 293 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 295 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 297 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 298 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 299 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:56:59,066 - INFO - Circuit initialization time: 87.716987 seconds.
-2024-12-14 00:56:59,066 - INFO - Estimating logical resources...
-2024-12-14 00:57:11,882 - INFO - Resource estimation time (seconds): 12.816292
-2024-12-14 00:57:11,882 - INFO - Analyzing task b99ec02f-b46a-43fe-8a87-1b3286e072d8...
-2024-12-14 00:57:11,882 - INFO - number of supporting files: 1
-2024-12-14 00:57:11,882 - INFO - supporting data file UUID: 5439a548-153b-4990-be12-f0e33c30fe63.
-2024-12-14 00:57:11,882 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz.
-2024-12-14 00:57:11,883 - INFO - assuming FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz is an FCIDUMP file.
-2024-12-14 00:57:11,883 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz...
-2024-12-14 00:57:11,887 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:57:12,524 - INFO - Authentication (publickey) successful!
-2024-12-14 00:57:12,539 - INFO - [chan 0] Opened sftp connection (server version 3)
-Downloading gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz to fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz...
-Parsing fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b
-Downloading gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz to fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz...
-Parsing fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b
-Downloading gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz to fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz...
-Parsing fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2
-Downloading gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz to fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz...
-Parsing fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7
-Downloading gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz to fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz...
-Parsing fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc
-Downloading gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz to fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz...
-Parsing fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488
-Downloading gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz to fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz...
-Parsing fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3
-Downloading gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz to fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz...
-Parsing fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5
-Downloading gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz to fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz...
-Parsing fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7
-Downloading gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz to fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz...
-Parsing fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74
-Downloading gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz to fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz...
-Parsing fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2
-Downloading gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz to fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz...
-Parsing fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd
-Downloading gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz to fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz...
-Parsing fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2
-Downloading gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz to fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz...
-Parsing fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5
-Downloading gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz to fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz...
-Parsing fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7
-Downloading gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz to fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz...
-Parsing fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d
-Downloading gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz to fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz...
-Parsing fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268
-Downloading gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz to fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz...
-Parsing fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5
-Downloading gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz to fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz...
-Parsing fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec
-Downloading gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz to fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz...
-Parsing fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89
-Downloading gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz to fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz...
-Parsing fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd
-Downloading gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz to fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz...
-Parsing fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6
-Downloading gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz to fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz...
-Parsing fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781
-Downloading gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz to fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz...
-Parsing fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94
-Downloading gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz to fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz...
-Parsing fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d
-Downloading gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz to fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz...
-Parsing fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2
-Downloading gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz to fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz...
-Parsing fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e
-Downloading gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz to fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz...
-Parsing fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981
-Downloading gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz to fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz...
-Parsing fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785
-Downloading gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz to FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz...
-Parsing FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b
-Downloading gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz to FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz...
-Parsing FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390
-Downloading gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz to FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz...
-Parsing FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070
-Downloading gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz to FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz...
-Parsing FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f
-Downloading gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz to FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz...
-Parsing FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857
-Downloading gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz to FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz...
-Parsing FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce
-2024-12-14 00:57:16,142 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:57:25,413 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 00:57:25,414 - INFO - Analyzing task 8874bf11-f594-41df-b8a0-d2a7441904a1...
-2024-12-14 00:57:25,414 - INFO - number of supporting files: 1
-2024-12-14 00:57:25,414 - INFO - supporting data file UUID: e2995852-9911-4021-a82f-5b14ddb2d5c8.
-2024-12-14 00:57:25,414 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz.
-2024-12-14 00:57:25,414 - INFO - assuming FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz is an FCIDUMP file.
-2024-12-14 00:57:25,414 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz...
-2024-12-14 00:57:25,419 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:57:26,113 - INFO - Authentication (publickey) successful!
-2024-12-14 00:57:26,129 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:57:33,725 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:57:45,997 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 00:57:45,997 - INFO - Analyzing task 202e6184-1e7d-4c02-a82a-f588b6abf809...
-2024-12-14 00:57:45,997 - INFO - number of supporting files: 1
-2024-12-14 00:57:45,997 - INFO - supporting data file UUID: 67acc90d-1a9e-49a7-98a1-8ca643dca272.
-2024-12-14 00:57:45,997 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz.
-2024-12-14 00:57:45,997 - INFO - assuming FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz is an FCIDUMP file.
-2024-12-14 00:57:45,997 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz...
-2024-12-14 00:57:46,002 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:57:46,646 - INFO - Authentication (publickey) successful!
-2024-12-14 00:57:46,667 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:57:46,720 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:57:46,772 - INFO - ===============================================
-2024-12-14 00:57:46,772 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 155 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:58:07,470 - INFO - Circuit initialization time: 20.697991 seconds.
-2024-12-14 00:58:07,470 - INFO - Estimating logical resources...
-2024-12-14 00:58:12,600 - INFO - Resource estimation time (seconds): 5.12968
-2024-12-14 00:58:12,600 - INFO - Analyzing task 7c8f0a36-cda5-4b33-bb46-4e58a15b37a1...
-2024-12-14 00:58:12,601 - INFO - number of supporting files: 1
-2024-12-14 00:58:12,601 - INFO - supporting data file UUID: 01d526fb-276e-4369-85d4-66a553a1d02e.
-2024-12-14 00:58:12,601 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz.
-2024-12-14 00:58:12,601 - INFO - assuming FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz is an FCIDUMP file.
-2024-12-14 00:58:12,601 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz...
-2024-12-14 00:58:12,606 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:58:13,244 - INFO - Authentication (publickey) successful!
-2024-12-14 00:58:13,259 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:58:13,321 - INFO - [chan 0] sftp session closed.
-2024-12-14 00:58:13,525 - INFO - ===============================================
-2024-12-14 00:58:13,526 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 273 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 00:59:35,764 - INFO - Circuit initialization time: 82.238035 seconds.
-2024-12-14 00:59:35,764 - INFO - Estimating logical resources...
-2024-12-14 00:59:47,555 - INFO - Resource estimation time (seconds): 11.791306
-2024-12-14 00:59:47,556 - INFO - Analyzing task cbab5937-5e2f-4f3f-819e-ede8b66d7238...
-2024-12-14 00:59:47,556 - INFO - number of supporting files: 1
-2024-12-14 00:59:47,556 - INFO - supporting data file UUID: b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.
-2024-12-14 00:59:47,556 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz.
-2024-12-14 00:59:47,556 - INFO - assuming FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz is an FCIDUMP file.
-2024-12-14 00:59:47,556 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz...
-2024-12-14 00:59:47,560 - INFO - Connected (version 2.0, client 0)
-2024-12-14 00:59:48,198 - INFO - Authentication (publickey) successful!
-2024-12-14 00:59:48,214 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 00:59:51,286 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:00:00,634 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 01:00:00,635 - INFO - Analyzing task c28e09e1-5983-42f7-9ecb-b271438ebcc8...
-2024-12-14 01:00:00,635 - INFO - number of supporting files: 1
-2024-12-14 01:00:00,635 - INFO - supporting data file UUID: 2101e6fa-9fb3-4697-98be-25a4e0de2079.
-2024-12-14 01:00:00,635 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz.
-2024-12-14 01:00:00,635 - INFO - assuming FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz is an FCIDUMP file.
-2024-12-14 01:00:00,635 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz...
-2024-12-14 01:00:00,648 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:00:01,356 - INFO - Authentication (publickey) successful!
-2024-12-14 01:00:01,382 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:00:10,264 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:00:24,532 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 01:00:24,537 - INFO - parsing ../problem_instances/problem_instance.be_0.19cada59-64cc-466c-8809-782a4f574dcc.json
-2024-12-14 01:00:24,537 - INFO - problem_instance UUID: 19cada59-64cc-466c-8809-782a4f574dcc
-2024-12-14 01:00:24,537 - INFO - problem_instance short name: be_0
-2024-12-14 01:00:24,537 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 01:00:24,552 - INFO - Skipping task 3fb92ecd-bcbc-43dd-9f29-aa56ea646b75 because no overlap was provided.
-2024-12-14 01:00:24,552 - INFO - Analyzing task afdc2f74-eb52-41ae-b72a-30e5a4c07013...
-2024-12-14 01:00:24,553 - INFO - number of supporting files: 2
-2024-12-14 01:00:24,553 - INFO - supporting data file UUID: f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.
-2024-12-14 01:00:24,553 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz.
-2024-12-14 01:00:24,553 - INFO - assuming fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz is an FCIDUMP file.
-2024-12-14 01:00:24,553 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz...
-2024-12-14 01:00:24,566 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:00:25,181 - INFO - Authentication (publickey) successful!
-2024-12-14 01:00:25,195 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:00:25,870 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:00:29,557 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 01:00:29,557 - INFO - supporting data file UUID: 26c5cd51-33c9-4c10-969e-07daa488861d.
-2024-12-14 01:00:29,557 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/be_cc-pVQZ.26c5cd51-33c9-4c10-969e-07daa488861d.chk.
-2024-12-14 01:00:29,558 - INFO - assuming be_cc-pVQZ.26c5cd51-33c9-4c10-969e-07daa488861d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:00:29,558 - INFO - Analyzing task 543e2ed4-a12d-495b-a246-1e4d905ad4a3...
-2024-12-14 01:00:29,558 - INFO - number of supporting files: 2
-2024-12-14 01:00:29,558 - INFO - supporting data file UUID: fdc83bd0-c9bd-47da-abee-99b743b36494.
-2024-12-14 01:00:29,558 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz.
-2024-12-14 01:00:29,558 - INFO - assuming fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz is an FCIDUMP file.
-2024-12-14 01:00:29,558 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz...
-2024-12-14 01:00:29,564 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:00:30,212 - INFO - Authentication (publickey) successful!
-2024-12-14 01:00:30,232 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:00:30,354 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:00:30,669 - INFO - ===============================================
-2024-12-14 01:00:30,669 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 293 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 297 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 301 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 302 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 303 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 304 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 305 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 306 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 307 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 308 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 309 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 310 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 311 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 312 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 313 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 314 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 01:02:39,390 - INFO - Circuit initialization time: 128.72114 seconds.
-2024-12-14 01:02:39,390 - INFO - Estimating logical resources...
-2024-12-14 01:02:54,666 - INFO - Resource estimation time (seconds): 15.275538
-2024-12-14 01:02:54,666 - INFO - supporting data file UUID: fedfefb8-56ab-4bf5-8607-fe3950fd5962.
-2024-12-14 01:02:54,666 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/be_cc-pVTZ.fedfefb8-56ab-4bf5-8607-fe3950fd5962.chk.
-2024-12-14 01:02:54,666 - INFO - assuming be_cc-pVTZ.fedfefb8-56ab-4bf5-8607-fe3950fd5962.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:02:54,668 - INFO - parsing ../problem_instances/problem_instance.f2_0.e3e78b41-577d-4536-a63f-7e968eeb6493.json
-2024-12-14 01:02:54,669 - INFO - problem_instance UUID: e3e78b41-577d-4536-a63f-7e968eeb6493
-2024-12-14 01:02:54,669 - INFO - problem_instance short name: f2_0
-2024-12-14 01:02:54,669 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 01:02:54,683 - INFO - Analyzing task 94fc2317-29af-43a1-aaec-dade9850ca27...
-2024-12-14 01:02:54,684 - INFO - number of supporting files: 2
-2024-12-14 01:02:54,684 - INFO - supporting data file UUID: ac269a87-2bc4-458e-8f4a-64f524c77044.
-2024-12-14 01:02:54,684 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz.
-2024-12-14 01:02:54,684 - INFO - assuming fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz is an FCIDUMP file.
-2024-12-14 01:02:54,684 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz...
-2024-12-14 01:02:54,688 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:02:55,344 - INFO - Authentication (publickey) successful!
-2024-12-14 01:02:55,362 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:02:55,462 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:02:55,745 - INFO - ===============================================
-2024-12-14 01:02:55,745 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 273 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 274 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 275 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 276 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 277 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 278 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 279 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 280 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 281 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 282 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 283 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 284 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 285 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 286 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 287 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 288 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 289 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 290 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 291 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 01:04:21,579 - INFO - Circuit initialization time: 85.833565 seconds.
-2024-12-14 01:04:21,579 - INFO - Estimating logical resources...
-2024-12-14 01:04:34,727 - INFO - Resource estimation time (seconds): 13.148531
-2024-12-14 01:04:34,728 - INFO - supporting data file UUID: 6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.
-2024-12-14 01:04:34,728 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVDZ.6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.chk.
-2024-12-14 01:04:34,728 - INFO - assuming f2_cc-pVDZ.6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:04:34,728 - INFO - Analyzing task fa8e83f2-cec5-4609-9b77-d713608a6b53...
-2024-12-14 01:04:34,728 - INFO - number of supporting files: 2
-2024-12-14 01:04:34,728 - INFO - supporting data file UUID: 29d645f8-ce30-4e18-9f41-644ac5f9d922.
-2024-12-14 01:04:34,728 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz.
-2024-12-14 01:04:34,728 - INFO - assuming fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz is an FCIDUMP file.
-2024-12-14 01:04:34,728 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz...
-2024-12-14 01:04:34,733 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:04:35,386 - INFO - Authentication (publickey) successful!
-2024-12-14 01:04:35,402 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:06:38,717 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:07:37,467 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 01:07:37,467 - INFO - supporting data file UUID: 5c169867-7d8c-44d8-8b34-4ecc34cd9649.
-2024-12-14 01:07:37,467 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVQZ.5c169867-7d8c-44d8-8b34-4ecc34cd9649.chk.
-2024-12-14 01:07:37,467 - INFO - assuming f2_cc-pVQZ.5c169867-7d8c-44d8-8b34-4ecc34cd9649.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:07:37,468 - INFO - Analyzing task 3fb371ad-c738-40ae-b9ae-80e5bce8f2ac...
-2024-12-14 01:07:37,468 - INFO - number of supporting files: 2
-2024-12-14 01:07:37,468 - INFO - supporting data file UUID: 3c3967d4-17c1-4947-9465-b9223b01e694.
-2024-12-14 01:07:37,468 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz.
-2024-12-14 01:07:37,468 - INFO - assuming fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz is an FCIDUMP file.
-2024-12-14 01:07:37,468 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz...
-2024-12-14 01:07:37,473 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:07:38,113 - INFO - Authentication (publickey) successful!
-2024-12-14 01:07:38,126 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:07:39,092 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:07:43,663 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 01:07:43,663 - INFO - supporting data file UUID: 8627efa5-5412-4e91-9cd0-2a582c3c7c20.
-2024-12-14 01:07:43,663 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVTZ.8627efa5-5412-4e91-9cd0-2a582c3c7c20.chk.
-2024-12-14 01:07:43,663 - INFO - assuming f2_cc-pVTZ.8627efa5-5412-4e91-9cd0-2a582c3c7c20.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:07:43,665 - INFO - parsing ../problem_instances/problem_instance.n2_0.9bd9cde6-6daa-441a-984e-ae1c1c051e91.json
-2024-12-14 01:07:43,666 - INFO - problem_instance UUID: 9bd9cde6-6daa-441a-984e-ae1c1c051e91
-2024-12-14 01:07:43,666 - INFO - problem_instance short name: n2_0
-2024-12-14 01:07:43,666 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 01:07:43,681 - INFO - Analyzing task b9c35349-927d-47d5-8e0c-e054bbf4e4e0...
-2024-12-14 01:07:43,682 - INFO - number of supporting files: 2
-2024-12-14 01:07:43,682 - INFO - supporting data file UUID: 60c52c22-d27a-4544-8b9c-6022507611f9.
-2024-12-14 01:07:43,682 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz.
-2024-12-14 01:07:43,682 - INFO - assuming fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz is an FCIDUMP file.
-2024-12-14 01:07:43,682 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz...
-2024-12-14 01:07:43,687 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:07:44,321 - INFO - Authentication (publickey) successful!
-2024-12-14 01:07:44,335 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:07:44,415 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:07:44,655 - INFO - ===============================================
-2024-12-14 01:07:44,655 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 320 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 321 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 322 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 323 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 324 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 325 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 326 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 327 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 328 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 329 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 01:09:04,947 - INFO - Circuit initialization time: 80.292178 seconds.
-2024-12-14 01:09:04,948 - INFO - Estimating logical resources...
-2024-12-14 01:09:21,442 - INFO - Resource estimation time (seconds): 16.494559
-2024-12-14 01:09:21,443 - INFO - supporting data file UUID: a107e4ce-0b43-437a-8c59-c2c249d1798d.
-2024-12-14 01:09:21,443 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVDZ.a107e4ce-0b43-437a-8c59-c2c249d1798d.chk.
-2024-12-14 01:09:21,443 - INFO - assuming n2_cc-pVDZ.a107e4ce-0b43-437a-8c59-c2c249d1798d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:09:21,443 - INFO - Analyzing task 9eed79e4-b195-4474-b280-fe9166a7a241...
-2024-12-14 01:09:21,443 - INFO - number of supporting files: 2
-2024-12-14 01:09:21,443 - INFO - supporting data file UUID: e84ef191-bfe0-4859-96b9-0613cad743d4.
-2024-12-14 01:09:21,443 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz.
-2024-12-14 01:09:21,443 - INFO - assuming fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz is an FCIDUMP file.
-2024-12-14 01:09:21,443 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz...
-2024-12-14 01:09:21,448 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:09:22,111 - INFO - Authentication (publickey) successful!
-2024-12-14 01:09:22,130 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:11:10,363 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:04,179 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 01:12:04,180 - INFO - supporting data file UUID: bb706eb0-f001-4938-8b70-b9f742942f45.
-2024-12-14 01:12:04,180 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVQZ.bb706eb0-f001-4938-8b70-b9f742942f45.chk.
-2024-12-14 01:12:04,180 - INFO - assuming n2_cc-pVQZ.bb706eb0-f001-4938-8b70-b9f742942f45.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:12:04,180 - INFO - Analyzing task 666185aa-b65d-4f73-8846-ae9693388d9d...
-2024-12-14 01:12:04,180 - INFO - number of supporting files: 2
-2024-12-14 01:12:04,180 - INFO - supporting data file UUID: 48512c28-04a3-4e3b-b6b2-3e4b654c1887.
-2024-12-14 01:12:04,180 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz.
-2024-12-14 01:12:04,180 - INFO - assuming fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz is an FCIDUMP file.
-2024-12-14 01:12:04,180 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz...
-2024-12-14 01:12:04,187 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:04,807 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:04,823 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:05,814 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:10,650 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 01:12:10,650 - INFO - supporting data file UUID: 5235f91b-19a0-4122-b54f-99051ccf0480.
-2024-12-14 01:12:10,651 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVTZ.5235f91b-19a0-4122-b54f-99051ccf0480.chk.
-2024-12-14 01:12:10,651 - INFO - assuming n2_cc-pVTZ.5235f91b-19a0-4122-b54f-99051ccf0480.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:12:10,653 - INFO - parsing ../problem_instances/problem_instance.fe_red.a8895776-3583-4884-fbc7-d6f9df21a7ac.json
-2024-12-14 01:12:10,653 - INFO - problem_instance UUID: a8895776-3583-4884-fbc7-d6f9df21a7ac
-2024-12-14 01:12:10,653 - INFO - problem_instance short name: fe_red
-2024-12-14 01:12:10,653 - INFO - contains 9 associated Hamiltonians.
-2024-12-14 01:12:10,668 - INFO - Analyzing task 4970c526-817f-4c04-8d7e-797526d5948d...
-2024-12-14 01:12:10,668 - INFO - number of supporting files: 1
-2024-12-14 01:12:10,668 - INFO - supporting data file UUID: 79e71b3e-6364-4972-b4b3-07841fa8ba97.
-2024-12-14 01:12:10,668 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz.
-2024-12-14 01:12:10,668 - INFO - assuming fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz is an FCIDUMP file.
-2024-12-14 01:12:10,668 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz...
-2024-12-14 01:12:10,681 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:11,313 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:11,330 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:11,572 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:12,852 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 01:12:12,852 - INFO - Analyzing task d27fb590-4e90-4d5a-bdb8-37fbf22f528b...
-2024-12-14 01:12:12,852 - INFO - number of supporting files: 1
-2024-12-14 01:12:12,852 - INFO - supporting data file UUID: e8f72c80-2fde-4bdc-ac1e-07220942f1c2.
-2024-12-14 01:12:12,852 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz.
-2024-12-14 01:12:12,852 - INFO - assuming fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz is an FCIDUMP file.
-2024-12-14 01:12:12,852 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz...
-2024-12-14 01:12:12,858 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:13,543 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:13,560 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:14,148 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:17,528 - INFO - Skipping Logical Resource Estimate because number of orbitals (53) exceeds maximum specified in config (32).
-2024-12-14 01:12:17,528 - INFO - Analyzing task a7cd2501-2f67-4fcd-b428-f6620f3596fe...
-2024-12-14 01:12:17,528 - INFO - number of supporting files: 1
-2024-12-14 01:12:17,528 - INFO - supporting data file UUID: 4854c3ff-b3ce-462b-ab8e-0b132cd880d0.
-2024-12-14 01:12:17,528 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz.
-2024-12-14 01:12:17,528 - INFO - assuming fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz is an FCIDUMP file.
-2024-12-14 01:12:17,528 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz...
-2024-12-14 01:12:17,534 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:18,165 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:18,183 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:19,087 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:24,082 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 01:12:24,082 - INFO - Analyzing task d3bcc63c-57ad-4346-8290-e36447186440...
-2024-12-14 01:12:24,082 - INFO - number of supporting files: 1
-2024-12-14 01:12:24,082 - INFO - supporting data file UUID: 379a0693-4ac3-4ff0-be33-7be3f6cad84f.
-2024-12-14 01:12:24,082 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz.
-2024-12-14 01:12:24,082 - INFO - assuming fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz is an FCIDUMP file.
-2024-12-14 01:12:24,082 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz...
-2024-12-14 01:12:24,087 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:24,713 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:24,731 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:24,931 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:26,602 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 01:12:26,602 - INFO - Analyzing task 41907f9f-923d-49e3-80a9-519962110ae7...
-2024-12-14 01:12:26,602 - INFO - number of supporting files: 1
-2024-12-14 01:12:26,602 - INFO - supporting data file UUID: 22ab7092-61bb-401f-ac43-912ec10ea48b.
-2024-12-14 01:12:26,602 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz.
-2024-12-14 01:12:26,602 - INFO - assuming fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz is an FCIDUMP file.
-2024-12-14 01:12:26,602 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz...
-2024-12-14 01:12:26,607 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:27,254 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:27,271 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:27,996 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:30,721 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 01:12:30,721 - INFO - Analyzing task ad9ceeaf-d7be-46b7-95a9-15bfd33f5022...
-2024-12-14 01:12:30,721 - INFO - number of supporting files: 1
-2024-12-14 01:12:30,721 - INFO - supporting data file UUID: 8a8780b0-a0ba-4b7e-9847-589302123e86.
-2024-12-14 01:12:30,721 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz.
-2024-12-14 01:12:30,721 - INFO - assuming fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz is an FCIDUMP file.
-2024-12-14 01:12:30,721 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz...
-2024-12-14 01:12:30,726 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:31,383 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:31,397 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:31,936 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:36,198 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 01:12:36,198 - INFO - Analyzing task adecdd92-73c7-416d-90da-b7a3da7ed50b...
-2024-12-14 01:12:36,198 - INFO - number of supporting files: 1
-2024-12-14 01:12:36,198 - INFO - supporting data file UUID: e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.
-2024-12-14 01:12:36,199 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz.
-2024-12-14 01:12:36,199 - INFO - assuming fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz is an FCIDUMP file.
-2024-12-14 01:12:36,199 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz...
-2024-12-14 01:12:36,204 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:36,847 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:36,862 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:37,052 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:38,675 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 01:12:38,675 - INFO - Analyzing task 03c70feb-49b8-4113-831a-05e3ae55c66b...
-2024-12-14 01:12:38,675 - INFO - number of supporting files: 1
-2024-12-14 01:12:38,676 - INFO - supporting data file UUID: eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.
-2024-12-14 01:12:38,676 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz.
-2024-12-14 01:12:38,676 - INFO - assuming fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz is an FCIDUMP file.
-2024-12-14 01:12:38,676 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz...
-2024-12-14 01:12:38,681 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:39,343 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:39,358 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:39,886 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:42,583 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 01:12:42,584 - INFO - Analyzing task 0e936335-6370-4587-92f0-02eafaf650ed...
-2024-12-14 01:12:42,584 - INFO - number of supporting files: 1
-2024-12-14 01:12:42,584 - INFO - supporting data file UUID: 5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.
-2024-12-14 01:12:42,584 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz.
-2024-12-14 01:12:42,584 - INFO - assuming fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz is an FCIDUMP file.
-2024-12-14 01:12:42,584 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz...
-2024-12-14 01:12:42,589 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:43,074 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:43,089 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:43,913 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:47,384 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 01:12:47,386 - INFO - parsing ../problem_instances/problem_instance.Fe_1.33c9a058-7a67-454c-856c-2519ba55b44d.json
-2024-12-14 01:12:47,387 - INFO - problem_instance UUID: 33c9a058-7a67-454c-856c-2519ba55b44d
-2024-12-14 01:12:47,387 - INFO - problem_instance short name: Fe_1
-2024-12-14 01:12:47,387 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:12:47,402 - INFO - Analyzing task a7e26b10-bd6b-457c-978e-9050f6529007...
-2024-12-14 01:12:47,402 - INFO - number of supporting files: 2
-2024-12-14 01:12:47,402 - INFO - supporting data file UUID: b57e3b82-2511-4c00-a850-f6aeba98b0b2.
-2024-12-14 01:12:47,402 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz.
-2024-12-14 01:12:47,403 - INFO - assuming fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz is an FCIDUMP file.
-2024-12-14 01:12:47,403 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz...
-2024-12-14 01:12:47,408 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:47,974 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:47,989 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:12:48,663 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:12:52,451 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 01:12:52,451 - INFO - supporting data file UUID: eaab709a-c628-4295-85d0-412071d1d7cc.
-2024-12-14 01:12:52,451 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe1_vdz.eaab709a-c628-4295-85d0-412071d1d7cc.chk.
-2024-12-14 01:12:52,451 - INFO - assuming Fe1_vdz.eaab709a-c628-4295-85d0-412071d1d7cc.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:12:52,451 - INFO - Analyzing task 6ab8d16c-b8f3-4780-b278-dad81646ca8c...
-2024-12-14 01:12:52,451 - INFO - number of supporting files: 2
-2024-12-14 01:12:52,451 - INFO - supporting data file UUID: b9615d62-11ee-49f7-8df4-df94466b2211.
-2024-12-14 01:12:52,451 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz.
-2024-12-14 01:12:52,451 - INFO - assuming fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz is an FCIDUMP file.
-2024-12-14 01:12:52,451 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz...
-2024-12-14 01:12:52,456 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:12:53,083 - INFO - Authentication (publickey) successful!
-2024-12-14 01:12:53,097 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:13:03,672 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:13:18,736 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 01:13:18,736 - INFO - supporting data file UUID: 7421b0eb-3b7f-42d6-ae6b-6583666b38e2.
-2024-12-14 01:13:18,736 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe1_vtz.7421b0eb-3b7f-42d6-ae6b-6583666b38e2.chk.
-2024-12-14 01:13:18,737 - INFO - assuming Fe1_vtz.7421b0eb-3b7f-42d6-ae6b-6583666b38e2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:13:18,742 - INFO - parsing ../problem_instances/problem_instance.ScO_0.7437abf0-1394-47ce-9218-d181f1732112.json
-2024-12-14 01:13:18,743 - INFO - problem_instance UUID: 7437abf0-1394-47ce-9218-d181f1732112
-2024-12-14 01:13:18,743 - INFO - problem_instance short name: ScO_0
-2024-12-14 01:13:18,743 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 01:13:18,759 - INFO - Analyzing task 9fa4fc3a-b0b9-4eaa-99ee-0469ae5a511d...
-2024-12-14 01:13:18,759 - INFO - number of supporting files: 2
-2024-12-14 01:13:18,759 - INFO - supporting data file UUID: 987498ce-5b91-4df6-924c-82d4841c17c2.
-2024-12-14 01:13:18,759 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz.
-2024-12-14 01:13:18,759 - INFO - assuming fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz is an FCIDUMP file.
-2024-12-14 01:13:18,759 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz...
-2024-12-14 01:13:18,765 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:13:19,419 - INFO - Authentication (publickey) successful!
-2024-12-14 01:13:19,433 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:13:24,595 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:13:36,798 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 01:13:36,798 - INFO - supporting data file UUID: 249d53eb-a925-4b2b-92eb-5a7b05c39069.
-2024-12-14 01:13:36,798 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/ScO_vdz.249d53eb-a925-4b2b-92eb-5a7b05c39069.chk.
-2024-12-14 01:13:36,799 - INFO - assuming ScO_vdz.249d53eb-a925-4b2b-92eb-5a7b05c39069.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:13:36,800 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0003.a37c86c0-1937-4f05-83ab-08a5fd104b7e.json
-2024-12-14 01:13:36,834 - INFO - problem_instance UUID: a37c86c0-1937-4f05-83ab-08a5fd104b7e
-2024-12-14 01:13:36,834 - INFO - problem_instance short name: planted_solution_0003
-2024-12-14 01:13:36,834 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 01:13:36,854 - INFO - Analyzing task 472bbfb1-c081-4df6-b966-32ce1194ab8c...
-2024-12-14 01:13:36,855 - INFO - number of supporting files: 1
-2024-12-14 01:13:36,855 - INFO - supporting data file UUID: efddd28a-383d-4929-9335-22e54ba2ffbe.
-2024-12-14 01:13:36,855 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz.
-2024-12-14 01:13:36,855 - INFO - assuming fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz is an FCIDUMP file.
-2024-12-14 01:13:36,855 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz...
-2024-12-14 01:13:36,860 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:13:37,500 - INFO - Authentication (publickey) successful!
-2024-12-14 01:13:37,520 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:13:37,596 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:13:37,972 - INFO - ===============================================
-2024-12-14 01:13:37,973 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 96 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 100 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 101 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 102 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 103 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 104 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 105 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 106 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 107 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 108 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 109 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 01:16:41,992 - INFO - Circuit initialization time: 184.019565 seconds.
-2024-12-14 01:16:41,992 - INFO - Estimating logical resources...
-2024-12-14 01:16:48,906 - INFO - Resource estimation time (seconds): 6.913784
-2024-12-14 01:16:48,908 - INFO - parsing ../problem_instances/problem_instance.h_c_n_0.8846a90e-96cb-4bc3-ad06-5388212f728e.json
-2024-12-14 01:16:48,909 - INFO - problem_instance UUID: 8846a90e-96cb-4bc3-ad06-5388212f728e
-2024-12-14 01:16:48,909 - INFO - problem_instance short name: h_c_n_0
-2024-12-14 01:16:48,909 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:16:48,924 - INFO - Analyzing task 94db0c2c-89f6-4c3d-b886-a3a6a2bdad1d...
-2024-12-14 01:16:48,924 - INFO - number of supporting files: 2
-2024-12-14 01:16:48,924 - INFO - supporting data file UUID: 8ab023ed-7cdf-49e6-87d9-369a13f2ac82.
-2024-12-14 01:16:48,924 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz.
-2024-12-14 01:16:48,924 - INFO - assuming fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz is an FCIDUMP file.
-2024-12-14 01:16:48,924 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz...
-2024-12-14 01:16:48,931 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:16:49,437 - INFO - Authentication (publickey) successful!
-2024-12-14 01:16:49,454 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:16:49,570 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:16:50,089 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 01:16:50,090 - INFO - supporting data file UUID: 46053168-a236-4e18-a305-965bdce3e019.
-2024-12-14 01:16:50,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_c_n_cc-pVDZ.46053168-a236-4e18-a305-965bdce3e019.chk.
-2024-12-14 01:16:50,090 - INFO - assuming h_c_n_cc-pVDZ.46053168-a236-4e18-a305-965bdce3e019.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:16:50,090 - INFO - Analyzing task c5ef4702-fc8d-4168-b594-8d5872fdb523...
-2024-12-14 01:16:50,090 - INFO - number of supporting files: 2
-2024-12-14 01:16:50,090 - INFO - supporting data file UUID: 6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.
-2024-12-14 01:16:50,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz.
-2024-12-14 01:16:50,090 - INFO - assuming fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz is an FCIDUMP file.
-2024-12-14 01:16:50,090 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz...
-2024-12-14 01:16:50,095 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:16:50,597 - INFO - Authentication (publickey) successful!
-2024-12-14 01:16:50,617 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:16:54,989 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:17:04,833 - INFO - Skipping Logical Resource Estimate because number of orbitals (74) exceeds maximum specified in config (32).
-2024-12-14 01:17:04,834 - INFO - supporting data file UUID: 6e127086-f92c-4ff5-ab61-7999670be0e7.
-2024-12-14 01:17:04,834 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_c_n_cc-pVTZ.6e127086-f92c-4ff5-ab61-7999670be0e7.chk.
-2024-12-14 01:17:04,834 - INFO - assuming h_c_n_cc-pVTZ.6e127086-f92c-4ff5-ab61-7999670be0e7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:17:04,836 - INFO - parsing ../problem_instances/problem_instance.si_h4_0.13c7144d-047e-4431-8d02-0b1d14c0526b.json
-2024-12-14 01:17:04,836 - INFO - problem_instance UUID: 13c7144d-047e-4431-8d02-0b1d14c0526b
-2024-12-14 01:17:04,837 - INFO - problem_instance short name: si_h4_0
-2024-12-14 01:17:04,837 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:17:04,852 - INFO - Analyzing task 2eaee11d-c1a0-4d2b-b29b-a38e658572f2...
-2024-12-14 01:17:04,852 - INFO - number of supporting files: 2
-2024-12-14 01:17:04,852 - INFO - supporting data file UUID: c37edb04-5163-4d5c-a54e-df5887f0d82e.
-2024-12-14 01:17:04,852 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz.
-2024-12-14 01:17:04,853 - INFO - assuming fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz is an FCIDUMP file.
-2024-12-14 01:17:04,853 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz...
-2024-12-14 01:17:04,866 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:17:05,528 - INFO - Authentication (publickey) successful!
-2024-12-14 01:17:05,544 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:17:05,774 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:17:07,087 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 01:17:07,087 - INFO - supporting data file UUID: de9aba1e-5c4d-4372-8895-d1495c7af8fa.
-2024-12-14 01:17:07,087 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h4_cc-pVDZ.de9aba1e-5c4d-4372-8895-d1495c7af8fa.chk.
-2024-12-14 01:17:07,087 - INFO - assuming si_h4_cc-pVDZ.de9aba1e-5c4d-4372-8895-d1495c7af8fa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:17:07,087 - INFO - Analyzing task 6ca72d49-425b-43f3-96e7-4067bacd0596...
-2024-12-14 01:17:07,087 - INFO - number of supporting files: 2
-2024-12-14 01:17:07,087 - INFO - supporting data file UUID: e709c0b6-d851-47d2-b72a-f4da8479a772.
-2024-12-14 01:17:07,088 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz.
-2024-12-14 01:17:07,088 - INFO - assuming fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz is an FCIDUMP file.
-2024-12-14 01:17:07,088 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz...
-2024-12-14 01:17:07,092 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:17:07,730 - INFO - Authentication (publickey) successful!
-2024-12-14 01:17:07,747 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:18:46,133 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:19:38,350 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 01:19:38,350 - INFO - supporting data file UUID: 10435f0a-a736-4c87-957b-f7a1183b2eca.
-2024-12-14 01:19:38,350 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h4_cc-pVTZ.10435f0a-a736-4c87-957b-f7a1183b2eca.chk.
-2024-12-14 01:19:38,350 - INFO - assuming si_h4_cc-pVTZ.10435f0a-a736-4c87-957b-f7a1183b2eca.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:19:38,354 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0009.8db449b1-265b-4a66-b965-a2b4833a88d1.json
-2024-12-14 01:19:38,356 - INFO - problem_instance UUID: 8db449b1-265b-4a66-b965-a2b4833a88d1
-2024-12-14 01:19:38,356 - INFO - problem_instance short name: planted_solution_0009
-2024-12-14 01:19:38,356 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 01:19:38,367 - INFO - Analyzing task 8f373cb0-952d-48c6-a871-8a10e52e7c19...
-2024-12-14 01:19:38,367 - INFO - number of supporting files: 1
-2024-12-14 01:19:38,367 - INFO - supporting data file UUID: bbbbba1c-868c-45a5-b16c-0c17536e83d8.
-2024-12-14 01:19:38,367 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz.
-2024-12-14 01:19:38,367 - INFO - assuming fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz is an FCIDUMP file.
-2024-12-14 01:19:38,367 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz...
-2024-12-14 01:19:38,372 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:19:39,033 - INFO - Authentication (publickey) successful!
-2024-12-14 01:19:39,050 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:19:42,018 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:19:50,608 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 01:19:50,609 - INFO - parsing ../problem_instances/problem_instance.Mn_1.11c8be98-d9c9-40ea-8d88-ea8c555028f6.json
-2024-12-14 01:19:50,610 - INFO - problem_instance UUID: 11c8be98-d9c9-40ea-8d88-ea8c555028f6
-2024-12-14 01:19:50,610 - INFO - problem_instance short name: Mn_1
-2024-12-14 01:19:50,610 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:19:50,625 - INFO - Analyzing task 9d82f7d4-165d-4499-8add-361a770d1d44...
-2024-12-14 01:19:50,625 - INFO - number of supporting files: 2
-2024-12-14 01:19:50,625 - INFO - supporting data file UUID: 51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.
-2024-12-14 01:19:50,625 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz.
-2024-12-14 01:19:50,625 - INFO - assuming fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz is an FCIDUMP file.
-2024-12-14 01:19:50,625 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz...
-2024-12-14 01:19:50,634 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:19:51,275 - INFO - Authentication (publickey) successful!
-2024-12-14 01:19:51,290 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:19:51,918 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:19:55,600 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 01:19:55,600 - INFO - supporting data file UUID: d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.
-2024-12-14 01:19:55,600 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn1_vdz.d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.chk.
-2024-12-14 01:19:55,600 - INFO - assuming Mn1_vdz.d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:19:55,601 - INFO - Analyzing task 29eecba9-3d4d-4672-8b19-475f53b2f1be...
-2024-12-14 01:19:55,601 - INFO - number of supporting files: 2
-2024-12-14 01:19:55,601 - INFO - supporting data file UUID: 00c757c4-3c99-4521-82b1-3e3a12d49854.
-2024-12-14 01:19:55,601 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz.
-2024-12-14 01:19:55,601 - INFO - assuming fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz is an FCIDUMP file.
-2024-12-14 01:19:55,601 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz...
-2024-12-14 01:19:55,606 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:19:56,269 - INFO - Authentication (publickey) successful!
-2024-12-14 01:19:56,285 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:20:21,952 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:20:41,886 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 01:20:41,886 - INFO - supporting data file UUID: e4481467-4b06-43b0-9e22-b3c5fa930709.
-2024-12-14 01:20:41,886 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn1_vtz.e4481467-4b06-43b0-9e22-b3c5fa930709.chk.
-2024-12-14 01:20:41,886 - INFO - assuming Mn1_vtz.e4481467-4b06-43b0-9e22-b3c5fa930709.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:20:41,892 - INFO - parsing ../problem_instances/problem_instance.c_h3_cl_0.379781b8-5732-492e-9fca-6fad3fc3692a.json
-2024-12-14 01:20:41,892 - INFO - problem_instance UUID: 379781b8-5732-492e-9fca-6fad3fc3692a
-2024-12-14 01:20:41,892 - INFO - problem_instance short name: c_h3_cl_0
-2024-12-14 01:20:41,892 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 01:20:41,903 - INFO - Analyzing task 0667179a-19eb-44b9-a544-dae8793fdc3f...
-2024-12-14 01:20:41,903 - INFO - number of supporting files: 2
-2024-12-14 01:20:41,903 - INFO - supporting data file UUID: 80298b55-8915-462f-8f20-e4332c94ed41.
-2024-12-14 01:20:41,903 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz.
-2024-12-14 01:20:41,903 - INFO - assuming fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz is an FCIDUMP file.
-2024-12-14 01:20:41,903 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz...
-2024-12-14 01:20:41,909 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:20:42,557 - INFO - Authentication (publickey) successful!
-2024-12-14 01:20:42,572 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:20:43,407 - INFO - [chan 0] sftp session closed.
-2024-12-14 01:20:47,558 - INFO - Skipping Logical Resource Estimate because number of orbitals (47) exceeds maximum specified in config (32).
-2024-12-14 01:20:47,558 - INFO - supporting data file UUID: a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.
-2024-12-14 01:20:47,558 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h3_cl_cc-pVDZ.a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.chk.
-2024-12-14 01:20:47,558 - INFO - assuming c_h3_cl_cc-pVDZ.a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 01:20:47,558 - INFO - Analyzing task ae315bef-f3c6-4c84-93c5-0d8ab510ece3...
-2024-12-14 01:20:47,558 - INFO - number of supporting files: 2
-2024-12-14 01:20:47,558 - INFO - supporting data file UUID: a53ae008-4ad2-4736-9a57-cfc011e3aace.
-2024-12-14 01:20:47,558 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz.
-2024-12-14 01:20:47,558 - INFO - assuming fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz is an FCIDUMP file.
-2024-12-14 01:20:47,558 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz...
-2024-12-14 01:20:47,564 - INFO - Connected (version 2.0, client 0)
-2024-12-14 01:20:48,227 - INFO - Authentication (publickey) successful!
-2024-12-14 01:20:48,242 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 01:20:52,967 - ERROR - Socket exception: Connection reset by peer (104)
-2024-12-14 01:20:52,968 - INFO - [chan 0] sftp session closed.
-Downloading gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz to FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz...
-Parsing FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63
-Downloading gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz to FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz...
-Parsing FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8
-Downloading gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz to FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz...
-Parsing FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272
-Downloading gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz to FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz...
-Parsing FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e
-Downloading gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz to FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz...
-Parsing FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4
-Downloading gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz to FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz...
-Parsing FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079
-Downloading gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz to fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz...
-Parsing fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb
-Downloading gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz to fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz...
-Parsing fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494
-Downloading gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz to fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz...
-Parsing fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044
-Downloading gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz to fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz...
-Parsing fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922
-Downloading gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz to fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz...
-Parsing fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694
-Downloading gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz to fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz...
-Parsing fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9
-Downloading gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz to fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz...
-Parsing fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4
-Downloading gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz to fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz...
-Parsing fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887
-Downloading gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz to fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz...
-Parsing fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97
-Downloading gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz to fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz...
-Parsing fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2
-Downloading gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz to fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz...
-Parsing fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0
-Downloading gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz to fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz...
-Parsing fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f
-Downloading gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz to fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz...
-Parsing fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b
-Downloading gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz to fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz...
-Parsing fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86
-Downloading gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz to fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz...
-Parsing fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e
-Downloading gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz to fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz...
-Parsing fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047
-Downloading gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz to fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz...
-Parsing fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3
-Downloading gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz to fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz...
-Parsing fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2
-Downloading gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz to fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz...
-Parsing fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211
-Downloading gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz to fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz...
-Parsing fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2
-Downloading gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz to fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz...
-Parsing fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe
-Downloading gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz to fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz...
-Parsing fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82
-Downloading gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz to fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz...
-Parsing fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de
-Downloading gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz to fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz...
-Parsing fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e
-Downloading gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz to fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz...
-Parsing fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772
-Downloading gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz to fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz...
-Parsing fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8
-Downloading gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz to fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz...
-Parsing fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4
-Downloading gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz to fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz...
-Parsing fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854
-Downloading gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz to fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz...
-Parsing fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41
-Downloading gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz to fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz...
-Traceback (most recent call last):
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp_client.py", line 887, in _read_response
-    t, data = self._read_packet()
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp.py", line 218, in _read_packet
-    data = self._read_all(size)
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp.py", line 199, in _read_all
-    raise EOFError()
-EOFError
-
-During handling of the above exception, another exception occurred:
-
-Traceback (most recent call last):
-  File "/home/labuser/Projects/qb-gsee-benchmark/scripts/./compute_all_LREs_script.py", line 319, in <module>
-    main(args)
-  File "/home/labuser/Projects/qb-gsee-benchmark/scripts/./compute_all_LREs_script.py", line 252, in main
-    resource_estimate = get_lqre(
-  File "/home/labuser/Projects/qb-gsee-benchmark/scripts/./compute_all_LREs_script.py", line 110, in get_lqre
-    fci = retrieve_fcidump_from_sftp(
-  File "/home/labuser/Projects/qb-gsee-benchmark/src/qb_gsee_benchmark/utils.py", line 38, in retrieve_fcidump_from_sftp
-    _fetch_file_from_sftp(
-  File "/home/labuser/Projects/qb-gsee-benchmark/src/qb_gsee_benchmark/utils.py", line 33, in _fetch_file_from_sftp
-    sftp.get(remote_path, local_path)
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp_client.py", line 840, in get
-    size = self.getfo(
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp_client.py", line 799, in getfo
-    return self._transfer_with_callback(
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp_client.py", line 678, in _transfer_with_callback
-    data = reader.read(32768)
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/file.py", line 203, in read
-    new_data = self._read(read_size)
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp_file.py", line 182, in _read
-    data = self._read_prefetch(size)
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp_file.py", line 162, in _read_prefetch
-    self.sftp._read_response()
-  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/paramiko/sftp_client.py", line 889, in _read_response
-    raise SSHException("Server connection dropped: {}".format(e))
-paramiko.ssh_exception.SSHException: Server connection dropped: 
-    Updating registry at `~/.julia/registries/General.toml`
-   Resolving package versions...
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-2024-12-14 13:38:56,164 - INFO - ===============================================
-2024-12-14 13:38:56,164 - INFO - overall start time: 2024-12-14 13:38:56.164564
-2024-12-14 13:38:56,164 - INFO - input directory: ../problem_instances/
-2024-12-14 13:38:56,165 - INFO - parsing 82 files in the input directory
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.cl2_0.0e393c20-3915-42b9-a8aa-29bf53548269.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Cu_0.1448d27d-bfa9-470f-a6c8-864a295b66f4.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.si2_h6_0.0c1dfb55-f021-409a-80b1-79c8c2908095.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.blue_dimer.dc8bdc56-5ebd-4996-6b81-81b1a06d8c76.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.benzene.f377cc27-366a-45af-b45a-c8478e4b6199.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Cr_1.02a8c4e9-9d15-4742-b4cc-7f47f69da0e5.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Ti_1.9823b0dd-87b6-4793-9741-e8cbcf2b50c0.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.V_0.a14a1e28-71c5-4e23-bf6e-dd9662a6df58.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.CuO_0.886ad5bf-d487-48c8-b08c-c9f82b84ed5d.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.TiO_0.0b91f99e-8de5-415d-a78e-f80e45d621ca.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.na2_0.edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.mn_mono.cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.FeO_0.55d0ed82-0560-4448-8459-c2ba00654d9d.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.p_h3_0.0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.h2_s_0.208f2e50-2b56-4e72-815a-cba5cec1264c.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Sc_0.67f72316-2262-44fb-8c0a-e159e1cd0cf0.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.na_cl_0.3f141f05-532b-478d-b38a-2ae07baadc88.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.c2_h2_0.0ca102a7-dad4-4d42-8c73-9acfa45378d7.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.li_f_0.e48e7467-1fcd-478b-a599-f4ce881c57b9.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.h2_c_o_0.25fd617b-8e7f-4422-9e97-cc3f6b0d3876.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.planted_solution_0011.766ba2da-e72a-4e03-a739-f97269026fc4.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.Mn_0.bc202949-d76c-4962-b937-5c12b298b8b4.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.planted_solution_0008.b57eb979-5c09-4974-97b4-5862e109a1ae.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.mo_n2.664ec8e4-09d5-41cc-6266-ddb26219366f.json
-2024-12-14 13:38:56,165 - INFO - file: problem_instance.li_h_0.6d355019-13aa-41fc-a530-31d5f968ba22.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.li2_0.3301a356-21a9-472b-8021-f02f4d2c9eec.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.h_f_0.892e3341-7186-44c6-9a1a-20f270ddc8b8.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.Fe_0.05abb33d-ecea-406f-8832-31a814b26dfd.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.planted_solution_0010.bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.ru_macho.b78a10f2-ce8a-43c0-69ec-4cf666d8e85c.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.Cu_1.d5c7ab73-dfc1-499e-9027-601476004107.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.n_h3_0.127cfea5-8a7d-45a0-9012-949816a0b8d9.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.planted_solution_0006.42958a3e-8b35-4992-acd8-6711848066c1.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.n2_h4_0.f1a6b508-75e8-4afb-9c81-fc61af11b523.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.c2_h4_0.9fbd9b4c-5ea9-4095-af7b-7d4491399e42.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.O_1.d712afaf-6ec4-42d9-b5fd-1edee3ec1046.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.cr_dimer.8ed1a800-a4c6-4bff-a6de-cb220554c42f.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.be_0.19cada59-64cc-466c-8809-782a4f574dcc.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.f2_0.e3e78b41-577d-4536-a63f-7e968eeb6493.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.n2_0.9bd9cde6-6daa-441a-984e-ae1c1c051e91.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.fe_red.a8895776-3583-4884-fbc7-d6f9df21a7ac.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.Fe_1.33c9a058-7a67-454c-856c-2519ba55b44d.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.ScO_0.7437abf0-1394-47ce-9218-d181f1732112.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.planted_solution_0003.a37c86c0-1937-4f05-83ab-08a5fd104b7e.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.h_c_n_0.8846a90e-96cb-4bc3-ad06-5388212f728e.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.si_h4_0.13c7144d-047e-4431-8d02-0b1d14c0526b.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.planted_solution_0009.8db449b1-265b-4a66-b965-a2b4833a88d1.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.Mn_1.11c8be98-d9c9-40ea-8d88-ea8c555028f6.json
-2024-12-14 13:38:56,166 - INFO - file: problem_instance.c_h3_cl_0.379781b8-5732-492e-9fca-6fad3fc3692a.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.p2_0.2e61ba35-b6b0-42b5-b3e8-d25bd83145ba.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.si_o_0.68f1a091-8652-4095-ba31-56f0e02e27d3.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h2_o_0.9b8083ab-ea59-47db-894c-95a0d2ba3cb6.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h_o_cl_0.ea2e13c5-6d80-466e-bd6b-6289e10ed82b.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c2_h6_0.b1c5ac4e-9b94-4e89-9557-da2026933172.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.planted_solution_0001.3d3b9e8a-7842-4ca1-bd82-eddb9804972d.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c_h4_0.e0f6ed02-6502-454b-bf2c-e7994e0510f4.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.V_1.18e1973e-d6cf-48d6-9ca4-c1af21ff7c98.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.planted_solution_0007.3aaf0bb4-b412-4746-922a-c380b4024d00.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.Ti_0.c1e4c7dd-2dc4-4dd0-889d-fb34f602965a.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.CrO_0.2140edd4-8eb3-4270-b753-278334998e3d.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.planted_solution_0002.00043d56-ed63-4266-907c-99c95c51b9db.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h3_c_o_h_0.5524b5e5-adba-4322-9808-69e75e4335b2.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.Cr_0.b8fe08a4-82fe-4636-9812-b1e0666f95b5.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h2_o2_0.cc7044d7-28e0-4fe2-bd6b-c9c758da4776.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c_o_0.1c3155e0-3679-4eff-bed0-57a1082672c3.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.si_h2_singlet_0.a0a07bfe-aac2-4d61-9425-009953899b3b.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c_s_0.f90280cc-c860-4ff1-a9ec-4841cec989f7.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h3_c_s_h_0.674b572a-3d6d-4418-8cc2-4755d90367ee.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.h_cl_0.586ce6a9-1876-459e-9b6c-be8bb1c4d1a5.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.s_o2_0.1d0b8322-24b3-407a-8246-07444bb020be.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.planted_solution_0004.e0adafc5-789e-43e6-8f9e-e718da28de3a.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.O_0.162f41da-af43-427c-a8bc-ae9fa97ace95.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.ozone.9560107e-f1ad-4480-aa51-ef03edda6e19.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.c_h2_singlet_0.7ca1486c-06a5-47c1-b8ab-eab491ffc68b.json
-2024-12-14 13:38:56,167 - INFO - file: problem_instance.VO_0.bcc86483-2a7e-4271-b6fc-238ef5e682f6.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.planted_solution_0005.7e0fb928-b0a9-4b44-89f1-7e0ee3b2bb13.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.ru_mono.7213642b-5f16-48be-d5e5-2bc42ebb8526.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.mo2_n2.90d4e4fc-1216-4846-b45f-198c0530e29b.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.MnO_0.e2212cdf-adef-454a-b218-05041d723c55.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.mo_n2_pincer.8a3787cc-d3d0-42a8-d9a9-7de2aed45208.json
-2024-12-14 13:38:56,168 - INFO - file: problem_instance.c_o2_0.3987b2dd-25bc-44e2-b516-dbc3f670a9c3.json
-2024-12-14 13:38:56,168 - INFO - parsing ../problem_instances/problem_instance.cl2_0.0e393c20-3915-42b9-a8aa-29bf53548269.json
-2024-12-14 13:38:56,168 - INFO - problem_instance UUID: 0e393c20-3915-42b9-a8aa-29bf53548269
-2024-12-14 13:38:56,168 - INFO - problem_instance short name: cl2_0
-2024-12-14 13:38:56,168 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 13:38:56,184 - INFO - Analyzing task c01649e2-8c5c-4827-a037-1ede2159e558...
-2024-12-14 13:38:56,184 - INFO - number of supporting files: 2
-2024-12-14 13:38:56,185 - INFO - supporting data file UUID: 8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.
-2024-12-14 13:38:56,185 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz.
-2024-12-14 13:38:56,185 - INFO - assuming fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz is an FCIDUMP file.
-2024-12-14 13:38:56,185 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz...
-2024-12-14 13:38:56,192 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:38:56,675 - INFO - Authentication (publickey) successful!
-2024-12-14 13:38:56,699 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:38:56,875 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:38:57,722 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 13:38:57,722 - INFO - supporting data file UUID: 5277b7f4-854c-45a4-a98e-95db9b40c071.
-2024-12-14 13:38:57,723 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVDZ.5277b7f4-854c-45a4-a98e-95db9b40c071.chk.
-2024-12-14 13:38:57,723 - INFO - assuming cl2_cc-pVDZ.5277b7f4-854c-45a4-a98e-95db9b40c071.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:38:57,723 - INFO - Analyzing task 214bb702-d7bc-4141-8cf3-f6979ba0f67a...
-2024-12-14 13:38:57,723 - INFO - number of supporting files: 2
-2024-12-14 13:38:57,723 - INFO - supporting data file UUID: 7b8c2dbd-8966-4eb4-83af-8acb07454e8a.
-2024-12-14 13:38:57,723 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz.
-2024-12-14 13:38:57,723 - INFO - assuming fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz is an FCIDUMP file.
-2024-12-14 13:38:57,723 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz...
-2024-12-14 13:38:57,728 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:38:58,380 - INFO - Authentication (publickey) successful!
-2024-12-14 13:38:58,398 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:42:33,117 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:43:50,469 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 13:43:50,469 - INFO - supporting data file UUID: dba5899f-164d-4e94-85f7-a1d8757179ab.
-2024-12-14 13:43:50,469 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVQZ.dba5899f-164d-4e94-85f7-a1d8757179ab.chk.
-2024-12-14 13:43:50,469 - INFO - assuming cl2_cc-pVQZ.dba5899f-164d-4e94-85f7-a1d8757179ab.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:43:50,469 - INFO - Analyzing task 35e4c771-0f4f-4413-b42f-132f1e606cb0...
-2024-12-14 13:43:50,469 - INFO - number of supporting files: 2
-2024-12-14 13:43:50,469 - INFO - supporting data file UUID: 781d0704-7a95-4183-9c50-cbdbd976884a.
-2024-12-14 13:43:50,469 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz.
-2024-12-14 13:43:50,469 - INFO - assuming fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz is an FCIDUMP file.
-2024-12-14 13:43:50,469 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz...
-2024-12-14 13:43:50,475 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:43:51,147 - INFO - Authentication (publickey) successful!
-2024-12-14 13:43:51,165 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:43:55,059 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:44:04,546 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 13:44:04,546 - INFO - supporting data file UUID: 27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.
-2024-12-14 13:44:04,547 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/cl2_cc-pVTZ.27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.chk.
-2024-12-14 13:44:04,547 - INFO - assuming cl2_cc-pVTZ.27d1c1c2-cd2f-4637-bb4c-b1535dff60a5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:44:04,549 - INFO - parsing ../problem_instances/problem_instance.Cu_0.1448d27d-bfa9-470f-a6c8-864a295b66f4.json
-2024-12-14 13:44:04,549 - INFO - problem_instance UUID: 1448d27d-bfa9-470f-a6c8-864a295b66f4
-2024-12-14 13:44:04,549 - INFO - problem_instance short name: Cu_0
-2024-12-14 13:44:04,550 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 13:44:04,568 - INFO - Analyzing task 7f0518e8-e2c8-4912-8268-4de4cd504084...
-2024-12-14 13:44:04,568 - INFO - number of supporting files: 2
-2024-12-14 13:44:04,568 - INFO - supporting data file UUID: 48434e2f-f09e-474e-b98c-af180386a258.
-2024-12-14 13:44:04,568 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz.
-2024-12-14 13:44:04,568 - INFO - assuming fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz is an FCIDUMP file.
-2024-12-14 13:44:04,568 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz...
-2024-12-14 13:44:04,573 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:44:05,238 - INFO - Authentication (publickey) successful!
-2024-12-14 13:44:05,255 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:44:05,872 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:44:09,489 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 13:44:09,489 - INFO - supporting data file UUID: 08885387-3319-4489-9487-56a333abf06b.
-2024-12-14 13:44:09,489 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu0_vdz.08885387-3319-4489-9487-56a333abf06b.chk.
-2024-12-14 13:44:09,489 - INFO - assuming Cu0_vdz.08885387-3319-4489-9487-56a333abf06b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:44:09,489 - INFO - Analyzing task 0f5171c4-cf55-4a82-99a2-c72edebce9c9...
-2024-12-14 13:44:09,489 - INFO - number of supporting files: 2
-2024-12-14 13:44:09,489 - INFO - supporting data file UUID: e304b6b5-b820-470d-a8b5-92d6354abd16.
-2024-12-14 13:44:09,489 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz.
-2024-12-14 13:44:09,489 - INFO - assuming fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz is an FCIDUMP file.
-2024-12-14 13:44:09,489 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz...
-2024-12-14 13:44:09,493 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:44:10,135 - INFO - Authentication (publickey) successful!
-2024-12-14 13:44:10,149 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:44:31,130 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:44:55,932 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 13:44:55,932 - INFO - supporting data file UUID: 34a02644-d0a3-4e3b-987c-c7962587f41a.
-2024-12-14 13:44:55,932 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu0_vtz.34a02644-d0a3-4e3b-987c-c7962587f41a.chk.
-2024-12-14 13:44:55,932 - INFO - assuming Cu0_vtz.34a02644-d0a3-4e3b-987c-c7962587f41a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:44:55,937 - INFO - parsing ../problem_instances/problem_instance.si2_h6_0.0c1dfb55-f021-409a-80b1-79c8c2908095.json
-2024-12-14 13:44:55,937 - INFO - problem_instance UUID: 0c1dfb55-f021-409a-80b1-79c8c2908095
-2024-12-14 13:44:55,938 - INFO - problem_instance short name: si2_h6_0
-2024-12-14 13:44:55,938 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 13:44:55,953 - INFO - Analyzing task 109f95c5-8561-458c-8f41-72be596b87e6...
-2024-12-14 13:44:55,953 - INFO - number of supporting files: 2
-2024-12-14 13:44:55,953 - INFO - supporting data file UUID: bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.
-2024-12-14 13:44:55,953 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz.
-2024-12-14 13:44:55,953 - INFO - assuming fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz is an FCIDUMP file.
-2024-12-14 13:44:55,953 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz...
-2024-12-14 13:44:55,958 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:44:56,618 - INFO - Authentication (publickey) successful!
-2024-12-14 13:44:56,636 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:45:04,175 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:45:16,444 - INFO - Skipping Logical Resource Estimate because number of orbitals (66) exceeds maximum specified in config (32).
-2024-12-14 13:45:16,445 - INFO - supporting data file UUID: 6494dcb3-de3a-4bd2-bd92-a121241b95aa.
-2024-12-14 13:45:16,445 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si2_h6_cc-pVDZ.6494dcb3-de3a-4bd2-bd92-a121241b95aa.chk.
-2024-12-14 13:45:16,445 - INFO - assuming si2_h6_cc-pVDZ.6494dcb3-de3a-4bd2-bd92-a121241b95aa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:45:16,446 - INFO - parsing ../problem_instances/problem_instance.blue_dimer.dc8bdc56-5ebd-4996-6b81-81b1a06d8c76.json
-2024-12-14 13:45:16,447 - INFO - problem_instance UUID: dc8bdc56-5ebd-4996-6b81-81b1a06d8c76
-2024-12-14 13:45:16,447 - INFO - problem_instance short name: blue_dimer
-2024-12-14 13:45:16,447 - INFO - contains 12 associated Hamiltonians.
-2024-12-14 13:45:16,462 - INFO - Analyzing task 9da97ef6-4bad-4c82-8576-9b8e539a7ba8...
-2024-12-14 13:45:16,462 - INFO - number of supporting files: 1
-2024-12-14 13:45:16,462 - INFO - supporting data file UUID: 46967cfc-d867-40e8-bef0-9655c46cef29.
-2024-12-14 13:45:16,462 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz.
-2024-12-14 13:45:16,463 - INFO - assuming fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz is an FCIDUMP file.
-2024-12-14 13:45:16,463 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz...
-2024-12-14 13:45:16,467 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:45:17,122 - INFO - Authentication (publickey) successful!
-2024-12-14 13:45:17,138 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:45:17,242 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:45:17,277 - INFO - ===============================================
-2024-12-14 13:45:17,277 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 13:46:10,685 - INFO - Circuit initialization time: 53.407307 seconds.
-2024-12-14 13:46:10,685 - INFO - Estimating logical resources...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/cotengra/hyperoptimizers/hyper.py:33: UserWarning: Couldn't import `kahypar` - skipping from default hyper optimizer and using basic `labels` method instead.
-  warnings.warn(
-2024-12-14 13:46:20,196 - INFO - Resource estimation time (seconds): 9.510511
-2024-12-14 13:46:20,196 - INFO - Analyzing task f20db1b1-86e3-4ddf-96ff-a6d37f331935...
-2024-12-14 13:46:20,196 - INFO - number of supporting files: 1
-2024-12-14 13:46:20,196 - INFO - supporting data file UUID: 85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.
-2024-12-14 13:46:20,196 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz.
-2024-12-14 13:46:20,196 - INFO - assuming fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz is an FCIDUMP file.
-2024-12-14 13:46:20,196 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz...
-2024-12-14 13:46:20,203 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:46:20,880 - INFO - Authentication (publickey) successful!
-2024-12-14 13:46:20,893 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:46:20,952 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:46:21,058 - INFO - ===============================================
-2024-12-14 13:46:21,058 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 13:47:28,924 - INFO - Circuit initialization time: 67.866051 seconds.
-2024-12-14 13:47:28,924 - INFO - Estimating logical resources...
-2024-12-14 13:47:41,045 - INFO - Resource estimation time (seconds): 12.120827
-2024-12-14 13:47:41,045 - INFO - Analyzing task 742be33c-0982-4b06-b324-1d86242e28d9...
-2024-12-14 13:47:41,046 - INFO - number of supporting files: 1
-2024-12-14 13:47:41,046 - INFO - supporting data file UUID: 7db0f859-073f-46af-9325-016a67229a4b.
-2024-12-14 13:47:41,046 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz.
-2024-12-14 13:47:41,046 - INFO - assuming fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz is an FCIDUMP file.
-2024-12-14 13:47:41,046 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz...
-2024-12-14 13:47:41,050 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:47:41,701 - INFO - Authentication (publickey) successful!
-2024-12-14 13:47:41,714 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:47:41,822 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:47:42,404 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 13:47:42,404 - INFO - Analyzing task 3b49563d-948a-4ecb-84a0-d3c0c2c0d217...
-2024-12-14 13:47:42,404 - INFO - number of supporting files: 1
-2024-12-14 13:47:42,404 - INFO - supporting data file UUID: 2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.
-2024-12-14 13:47:42,404 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz.
-2024-12-14 13:47:42,404 - INFO - assuming fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz is an FCIDUMP file.
-2024-12-14 13:47:42,405 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz...
-2024-12-14 13:47:42,410 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:47:43,061 - INFO - Authentication (publickey) successful!
-2024-12-14 13:47:43,079 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:47:43,210 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:47:43,976 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 13:47:43,976 - INFO - Analyzing task 950da653-13ce-4cd7-95d8-5045ab03d4bc...
-2024-12-14 13:47:43,976 - INFO - number of supporting files: 1
-2024-12-14 13:47:43,976 - INFO - supporting data file UUID: a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.
-2024-12-14 13:47:43,976 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz.
-2024-12-14 13:47:43,977 - INFO - assuming fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz is an FCIDUMP file.
-2024-12-14 13:47:43,977 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz...
-2024-12-14 13:47:43,983 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:47:44,636 - INFO - Authentication (publickey) successful!
-2024-12-14 13:47:44,650 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:47:44,702 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:47:44,756 - INFO - ===============================================
-2024-12-14 13:47:44,756 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 13:48:15,189 - INFO - Circuit initialization time: 30.432783 seconds.
-2024-12-14 13:48:15,189 - INFO - Estimating logical resources...
-2024-12-14 13:48:21,642 - INFO - Resource estimation time (seconds): 6.45274
-2024-12-14 13:48:21,642 - INFO - Analyzing task 13821f5c-78a6-485c-9006-a17a234cde9f...
-2024-12-14 13:48:21,642 - INFO - number of supporting files: 1
-2024-12-14 13:48:21,642 - INFO - supporting data file UUID: d9707874-28d5-48b6-824e-a2e6c8753437.
-2024-12-14 13:48:21,642 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz.
-2024-12-14 13:48:21,642 - INFO - assuming fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz is an FCIDUMP file.
-2024-12-14 13:48:21,642 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz...
-2024-12-14 13:48:21,648 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:48:22,307 - INFO - Authentication (publickey) successful!
-2024-12-14 13:48:22,323 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:48:22,378 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:48:22,484 - INFO - ===============================================
-2024-12-14 13:48:22,485 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 13:49:28,556 - INFO - Circuit initialization time: 66.071282 seconds.
-2024-12-14 13:49:28,556 - INFO - Estimating logical resources...
-2024-12-14 13:49:40,676 - INFO - Resource estimation time (seconds): 12.119783
-2024-12-14 13:49:40,676 - INFO - Analyzing task 765594e5-44ac-41a2-89a7-f2ac03536379...
-2024-12-14 13:49:40,676 - INFO - number of supporting files: 1
-2024-12-14 13:49:40,676 - INFO - supporting data file UUID: 727ab190-e399-4bb6-a9b3-20ae57789bac.
-2024-12-14 13:49:40,676 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz.
-2024-12-14 13:49:40,677 - INFO - assuming fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz is an FCIDUMP file.
-2024-12-14 13:49:40,677 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz...
-2024-12-14 13:49:40,690 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:49:41,322 - INFO - Authentication (publickey) successful!
-2024-12-14 13:49:41,342 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:49:41,457 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:49:42,040 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 13:49:42,040 - INFO - Analyzing task 858b9683-fc6c-4ebe-8c33-27f0d848f24f...
-2024-12-14 13:49:42,040 - INFO - number of supporting files: 1
-2024-12-14 13:49:42,041 - INFO - supporting data file UUID: e986eb83-6b9d-439e-85ca-a9b931eef4a2.
-2024-12-14 13:49:42,041 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz.
-2024-12-14 13:49:42,041 - INFO - assuming fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz is an FCIDUMP file.
-2024-12-14 13:49:42,041 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz...
-2024-12-14 13:49:42,047 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:49:42,691 - INFO - Authentication (publickey) successful!
-2024-12-14 13:49:42,707 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:49:42,813 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:49:43,540 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 13:49:43,540 - INFO - Analyzing task 1a013e9f-7eab-4a1b-b486-1d9e2d99e754...
-2024-12-14 13:49:43,540 - INFO - number of supporting files: 1
-2024-12-14 13:49:43,540 - INFO - supporting data file UUID: 6bf3207c-664b-4ed3-8e74-82b42e277234.
-2024-12-14 13:49:43,540 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz.
-2024-12-14 13:49:43,540 - INFO - assuming fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz is an FCIDUMP file.
-2024-12-14 13:49:43,540 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz...
-2024-12-14 13:49:43,545 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:49:44,195 - INFO - Authentication (publickey) successful!
-2024-12-14 13:49:44,212 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:49:44,286 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:49:44,345 - INFO - ===============================================
-2024-12-14 13:49:44,345 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 13:50:21,759 - INFO - Circuit initialization time: 37.413764 seconds.
-2024-12-14 13:50:21,759 - INFO - Estimating logical resources...
-2024-12-14 13:50:29,468 - INFO - Resource estimation time (seconds): 7.70904
-2024-12-14 13:50:29,468 - INFO - Analyzing task 001a0d11-165a-49c5-a334-643023029f40...
-2024-12-14 13:50:29,468 - INFO - number of supporting files: 1
-2024-12-14 13:50:29,468 - INFO - supporting data file UUID: fb3ecfad-6450-423e-aa58-d5cddab6f0f6.
-2024-12-14 13:50:29,468 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz.
-2024-12-14 13:50:29,469 - INFO - assuming fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz is an FCIDUMP file.
-2024-12-14 13:50:29,469 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz...
-2024-12-14 13:50:29,473 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:50:30,127 - INFO - Authentication (publickey) successful!
-2024-12-14 13:50:30,141 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:50:30,206 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:50:30,477 - INFO - ===============================================
-2024-12-14 13:50:30,477 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 13:53:27,004 - INFO - Circuit initialization time: 176.526281 seconds.
-2024-12-14 13:53:27,004 - INFO - Estimating logical resources...
-2024-12-14 13:53:53,909 - INFO - Resource estimation time (seconds): 26.904671
-2024-12-14 13:53:53,909 - INFO - Analyzing task 1c9508e3-b9fe-44f1-ae58-c6339ef43f47...
-2024-12-14 13:53:53,909 - INFO - number of supporting files: 1
-2024-12-14 13:53:53,909 - INFO - supporting data file UUID: dc406285-bac1-4b99-afbf-06728b7d699b.
-2024-12-14 13:53:53,909 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz.
-2024-12-14 13:53:53,909 - INFO - assuming fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz is an FCIDUMP file.
-2024-12-14 13:53:53,909 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz...
-2024-12-14 13:53:53,913 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:53:54,573 - INFO - Authentication (publickey) successful!
-2024-12-14 13:53:54,588 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:53:54,688 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:53:55,274 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 13:53:55,274 - INFO - Analyzing task 6713517a-ab65-4381-aae1-0839dcd6c1a0...
-2024-12-14 13:53:55,274 - INFO - number of supporting files: 1
-2024-12-14 13:53:55,275 - INFO - supporting data file UUID: af9d6a83-7898-4c13-80eb-a83a533ebf2d.
-2024-12-14 13:53:55,275 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz.
-2024-12-14 13:53:55,275 - INFO - assuming fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz is an FCIDUMP file.
-2024-12-14 13:53:55,275 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz...
-2024-12-14 13:53:55,280 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:53:55,933 - INFO - Authentication (publickey) successful!
-2024-12-14 13:53:55,949 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:53:56,064 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:53:56,794 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 13:53:56,796 - INFO - parsing ../problem_instances/problem_instance.benzene.f377cc27-366a-45af-b45a-c8478e4b6199.json
-2024-12-14 13:53:56,796 - INFO - problem_instance UUID: f377cc27-366a-45af-b45a-c8478e4b6199
-2024-12-14 13:53:56,796 - INFO - problem_instance short name: benzene
-2024-12-14 13:53:56,796 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 13:53:56,812 - INFO - Analyzing task b86457a4-abf4-43c9-9c08-2397e95b7c0f...
-2024-12-14 13:53:56,812 - INFO - number of supporting files: 1
-2024-12-14 13:53:56,812 - INFO - supporting data file UUID: 4c655f65-1899-469c-975a-a3caec750697.
-2024-12-14 13:53:56,812 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz.
-2024-12-14 13:53:56,812 - INFO - assuming FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz is an FCIDUMP file.
-2024-12-14 13:53:56,812 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz...
-2024-12-14 13:53:56,818 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:53:57,458 - INFO - Authentication (publickey) successful!
-2024-12-14 13:53:57,472 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:53:57,532 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:53:57,684 - INFO - ===============================================
-2024-12-14 13:53:57,684 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 396 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 398 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 399 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 400 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 401 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 402 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 403 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 404 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 405 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 406 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 407 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 13:55:49,292 - INFO - Circuit initialization time: 111.608076 seconds.
-2024-12-14 13:55:49,292 - INFO - Estimating logical resources...
-2024-12-14 13:56:13,811 - INFO - Resource estimation time (seconds): 24.51864
-2024-12-14 13:56:13,811 - INFO - Analyzing task 7148b36a-0571-4a41-9239-19a97339f68a...
-2024-12-14 13:56:13,811 - INFO - number of supporting files: 1
-2024-12-14 13:56:13,811 - INFO - supporting data file UUID: 96ff0e22-a3ab-49f3-aee9-9a1886cbf850.
-2024-12-14 13:56:13,811 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz.
-2024-12-14 13:56:13,811 - INFO - assuming FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz is an FCIDUMP file.
-2024-12-14 13:56:13,811 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz...
-2024-12-14 13:56:13,817 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:56:14,505 - INFO - Authentication (publickey) successful!
-2024-12-14 13:56:14,522 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:56:39,301 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:57:04,070 - INFO - Skipping Logical Resource Estimate because number of orbitals (108) exceeds maximum specified in config (32).
-2024-12-14 13:57:04,078 - INFO - parsing ../problem_instances/problem_instance.Cr_1.02a8c4e9-9d15-4742-b4cc-7f47f69da0e5.json
-2024-12-14 13:57:04,079 - INFO - problem_instance UUID: 02a8c4e9-9d15-4742-b4cc-7f47f69da0e5
-2024-12-14 13:57:04,079 - INFO - problem_instance short name: Cr_1
-2024-12-14 13:57:04,079 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 13:57:04,094 - INFO - Analyzing task b24b71b9-971a-4aca-9fc0-7198d16ca9ed...
-2024-12-14 13:57:04,095 - INFO - number of supporting files: 2
-2024-12-14 13:57:04,095 - INFO - supporting data file UUID: 69a1826c-1bee-4855-8f5f-5df29035bfca.
-2024-12-14 13:57:04,095 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz.
-2024-12-14 13:57:04,095 - INFO - assuming fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz is an FCIDUMP file.
-2024-12-14 13:57:04,095 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz...
-2024-12-14 13:57:04,100 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:57:04,745 - INFO - Authentication (publickey) successful!
-2024-12-14 13:57:04,761 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 13:57:05,125 - INFO - [chan 0] sftp session closed.
-2024-12-14 13:57:07,338 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 13:57:07,338 - INFO - supporting data file UUID: 4ead3f70-392f-45e8-aa0d-f5e364d389d7.
-2024-12-14 13:57:07,338 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vdz.4ead3f70-392f-45e8-aa0d-f5e364d389d7.chk.
-2024-12-14 13:57:07,338 - INFO - assuming Cr1_vdz.4ead3f70-392f-45e8-aa0d-f5e364d389d7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 13:57:07,338 - INFO - Analyzing task e604a906-55fa-4b3f-bf17-c24a30312b84...
-2024-12-14 13:57:07,338 - INFO - number of supporting files: 2
-2024-12-14 13:57:07,338 - INFO - supporting data file UUID: 4e3649dd-9050-4acc-93f6-a09c962e89d7.
-2024-12-14 13:57:07,338 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz.
-2024-12-14 13:57:07,338 - INFO - assuming fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz is an FCIDUMP file.
-2024-12-14 13:57:07,338 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz...
-2024-12-14 13:57:07,344 - INFO - Connected (version 2.0, client 0)
-2024-12-14 13:57:07,982 - INFO - Authentication (publickey) successful!
-2024-12-14 13:57:07,996 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:02:03,689 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:03:35,217 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-14 14:03:35,218 - INFO - supporting data file UUID: ad74c129-2df4-4066-8972-6c0105bc0fa7.
-2024-12-14 14:03:35,218 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vqz.ad74c129-2df4-4066-8972-6c0105bc0fa7.chk.
-2024-12-14 14:03:35,218 - INFO - assuming Cr1_vqz.ad74c129-2df4-4066-8972-6c0105bc0fa7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:03:35,218 - INFO - Analyzing task f4b120e9-acd0-4c7c-89e2-cc082f52f5cf...
-2024-12-14 14:03:35,218 - INFO - number of supporting files: 2
-2024-12-14 14:03:35,218 - INFO - supporting data file UUID: efaceb68-6fae-491a-bb90-1e3e3463f010.
-2024-12-14 14:03:35,218 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz.
-2024-12-14 14:03:35,218 - INFO - assuming fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz is an FCIDUMP file.
-2024-12-14 14:03:35,218 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz...
-2024-12-14 14:03:35,223 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:03:35,872 - INFO - Authentication (publickey) successful!
-2024-12-14 14:03:35,887 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:03:45,755 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:04:01,874 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:04:01,874 - INFO - supporting data file UUID: 94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.
-2024-12-14 14:04:01,874 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr1_vtz.94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.chk.
-2024-12-14 14:04:01,874 - INFO - assuming Cr1_vtz.94cd9acd-268f-45c1-a101-1f2aa1ba8c7d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:04:01,879 - INFO - parsing ../problem_instances/problem_instance.Ti_1.9823b0dd-87b6-4793-9741-e8cbcf2b50c0.json
-2024-12-14 14:04:01,879 - INFO - problem_instance UUID: 9823b0dd-87b6-4793-9741-e8cbcf2b50c0
-2024-12-14 14:04:01,879 - INFO - problem_instance short name: Ti_1
-2024-12-14 14:04:01,879 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:04:01,894 - INFO - Analyzing task 2cd76a23-0514-458a-b588-94e2d10564d3...
-2024-12-14 14:04:01,895 - INFO - number of supporting files: 2
-2024-12-14 14:04:01,895 - INFO - supporting data file UUID: 760e312c-9982-486d-b50e-d9acb003aedc.
-2024-12-14 14:04:01,895 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz.
-2024-12-14 14:04:01,895 - INFO - assuming fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz is an FCIDUMP file.
-2024-12-14 14:04:01,895 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz...
-2024-12-14 14:04:01,901 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:04:02,620 - INFO - Authentication (publickey) successful!
-2024-12-14 14:04:02,642 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:04:03,830 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:04:07,485 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 14:04:07,485 - INFO - supporting data file UUID: c4414ea6-320e-4c98-89ef-cc16d7932fd7.
-2024-12-14 14:04:07,485 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti1_vdz.c4414ea6-320e-4c98-89ef-cc16d7932fd7.chk.
-2024-12-14 14:04:07,486 - INFO - assuming Ti1_vdz.c4414ea6-320e-4c98-89ef-cc16d7932fd7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:04:07,486 - INFO - Analyzing task c7049602-5460-4277-8148-d9c66012f8f0...
-2024-12-14 14:04:07,486 - INFO - number of supporting files: 2
-2024-12-14 14:04:07,486 - INFO - supporting data file UUID: 2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.
-2024-12-14 14:04:07,486 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz.
-2024-12-14 14:04:07,486 - INFO - assuming fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz is an FCIDUMP file.
-2024-12-14 14:04:07,486 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz...
-2024-12-14 14:04:07,491 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:04:08,165 - INFO - Authentication (publickey) successful!
-2024-12-14 14:04:08,183 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:04:28,849 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:04:52,383 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:04:52,383 - INFO - supporting data file UUID: 1391b3e4-1862-4808-8990-dab576dade6a.
-2024-12-14 14:04:52,383 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti1_vtz.1391b3e4-1862-4808-8990-dab576dade6a.chk.
-2024-12-14 14:04:52,383 - INFO - assuming Ti1_vtz.1391b3e4-1862-4808-8990-dab576dade6a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:04:52,388 - INFO - parsing ../problem_instances/problem_instance.V_0.a14a1e28-71c5-4e23-bf6e-dd9662a6df58.json
-2024-12-14 14:04:52,388 - INFO - problem_instance UUID: a14a1e28-71c5-4e23-bf6e-dd9662a6df58
-2024-12-14 14:04:52,388 - INFO - problem_instance short name: V_0
-2024-12-14 14:04:52,388 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:04:52,404 - INFO - Analyzing task 0f0c8766-4bf5-4c1e-991a-9dafe9bc8f27...
-2024-12-14 14:04:52,404 - INFO - number of supporting files: 2
-2024-12-14 14:04:52,405 - INFO - supporting data file UUID: 950e31e2-142f-480b-b0d1-174381bdb64a.
-2024-12-14 14:04:52,405 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz.
-2024-12-14 14:04:52,405 - INFO - assuming fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz is an FCIDUMP file.
-2024-12-14 14:04:52,405 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz...
-2024-12-14 14:04:52,409 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:04:53,079 - INFO - Authentication (publickey) successful!
-2024-12-14 14:04:53,093 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:04:53,917 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:04:58,318 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 14:04:58,318 - INFO - supporting data file UUID: 5b236de2-1bb4-442b-8519-0af6e44d857d.
-2024-12-14 14:04:58,318 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V0_vdz.5b236de2-1bb4-442b-8519-0af6e44d857d.chk.
-2024-12-14 14:04:58,318 - INFO - assuming V0_vdz.5b236de2-1bb4-442b-8519-0af6e44d857d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:04:58,318 - INFO - Analyzing task 338f4b6e-775c-413b-a508-9132659ebbc3...
-2024-12-14 14:04:58,318 - INFO - number of supporting files: 2
-2024-12-14 14:04:58,319 - INFO - supporting data file UUID: d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.
-2024-12-14 14:04:58,319 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz.
-2024-12-14 14:04:58,319 - INFO - assuming fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz is an FCIDUMP file.
-2024-12-14 14:04:58,319 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz...
-2024-12-14 14:04:58,324 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:04:58,957 - INFO - Authentication (publickey) successful!
-2024-12-14 14:04:58,973 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:05:35,388 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:06:07,332 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:06:07,332 - INFO - supporting data file UUID: 1c843e96-bab4-4f23-8a9e-df61638fb804.
-2024-12-14 14:06:07,332 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V0_vtz.1c843e96-bab4-4f23-8a9e-df61638fb804.chk.
-2024-12-14 14:06:07,332 - INFO - assuming V0_vtz.1c843e96-bab4-4f23-8a9e-df61638fb804.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:06:07,337 - INFO - parsing ../problem_instances/problem_instance.CuO_0.886ad5bf-d487-48c8-b08c-c9f82b84ed5d.json
-2024-12-14 14:06:07,337 - INFO - problem_instance UUID: 886ad5bf-d487-48c8-b08c-c9f82b84ed5d
-2024-12-14 14:06:07,337 - INFO - problem_instance short name: CuO_0
-2024-12-14 14:06:07,337 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:06:07,353 - INFO - Analyzing task 37e1f17b-384d-423d-860b-c75b9dcff951...
-2024-12-14 14:06:07,353 - INFO - number of supporting files: 2
-2024-12-14 14:06:07,353 - INFO - supporting data file UUID: da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.
-2024-12-14 14:06:07,353 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz.
-2024-12-14 14:06:07,353 - INFO - assuming fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz is an FCIDUMP file.
-2024-12-14 14:06:07,353 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz...
-2024-12-14 14:06:07,358 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:06:07,991 - INFO - Authentication (publickey) successful!
-2024-12-14 14:06:08,005 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:06:17,040 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:06:31,620 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 14:06:31,620 - INFO - supporting data file UUID: c4e62caf-cab0-444f-88f2-ce58f87079f2.
-2024-12-14 14:06:31,620 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/CuO_vdz.c4e62caf-cab0-444f-88f2-ce58f87079f2.chk.
-2024-12-14 14:06:31,620 - INFO - assuming CuO_vdz.c4e62caf-cab0-444f-88f2-ce58f87079f2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:06:31,622 - INFO - parsing ../problem_instances/problem_instance.TiO_0.0b91f99e-8de5-415d-a78e-f80e45d621ca.json
-2024-12-14 14:06:31,622 - INFO - problem_instance UUID: 0b91f99e-8de5-415d-a78e-f80e45d621ca
-2024-12-14 14:06:31,622 - INFO - problem_instance short name: TiO_0
-2024-12-14 14:06:31,622 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:06:31,634 - INFO - Analyzing task 84aa9e2d-18e6-4689-9274-28e89ef44080...
-2024-12-14 14:06:31,634 - INFO - number of supporting files: 2
-2024-12-14 14:06:31,634 - INFO - supporting data file UUID: 98719f34-8ba8-4557-a9fd-b28a84fe7dd1.
-2024-12-14 14:06:31,634 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz.
-2024-12-14 14:06:31,634 - INFO - assuming fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz is an FCIDUMP file.
-2024-12-14 14:06:31,634 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz...
-2024-12-14 14:06:31,640 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:06:32,290 - INFO - Authentication (publickey) successful!
-2024-12-14 14:06:32,308 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:06:39,988 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:06:54,346 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 14:06:54,346 - INFO - supporting data file UUID: bee1776c-8031-4f23-a403-4475699e873f.
-2024-12-14 14:06:54,346 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/TiO_vdz.bee1776c-8031-4f23-a403-4475699e873f.chk.
-2024-12-14 14:06:54,346 - INFO - assuming TiO_vdz.bee1776c-8031-4f23-a403-4475699e873f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:06:54,348 - INFO - parsing ../problem_instances/problem_instance.na2_0.edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76.json
-2024-12-14 14:06:54,348 - INFO - problem_instance UUID: edb1dfc4-c9d0-41ce-902a-2cfcf97c0c76
-2024-12-14 14:06:54,348 - INFO - problem_instance short name: na2_0
-2024-12-14 14:06:54,348 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:06:54,364 - INFO - Analyzing task 4fb7e994-8e7a-4acd-86d4-bb52db824cfc...
-2024-12-14 14:06:54,364 - INFO - number of supporting files: 2
-2024-12-14 14:06:54,364 - INFO - supporting data file UUID: 4ceb8edc-937e-4cb6-9e42-51b6760b2557.
-2024-12-14 14:06:54,364 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz.
-2024-12-14 14:06:54,364 - INFO - assuming fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz is an FCIDUMP file.
-2024-12-14 14:06:54,364 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz...
-2024-12-14 14:06:54,369 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:06:55,004 - INFO - Authentication (publickey) successful!
-2024-12-14 14:06:55,020 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:06:55,147 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:06:55,841 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 14:06:55,841 - INFO - supporting data file UUID: 2014a3d7-1779-4d85-810f-ab908557987f.
-2024-12-14 14:06:55,841 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVDZ.2014a3d7-1779-4d85-810f-ab908557987f.chk.
-2024-12-14 14:06:55,841 - INFO - assuming na2_cc-pVDZ.2014a3d7-1779-4d85-810f-ab908557987f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:06:55,841 - INFO - Analyzing task f96de7fe-5c88-4083-8c48-72bc094cccfd...
-2024-12-14 14:06:55,841 - INFO - number of supporting files: 2
-2024-12-14 14:06:55,841 - INFO - supporting data file UUID: 4d93ba0f-4ad6-4107-b495-9284d226e13d.
-2024-12-14 14:06:55,841 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz.
-2024-12-14 14:06:55,841 - INFO - assuming fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz is an FCIDUMP file.
-2024-12-14 14:06:55,841 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz...
-2024-12-14 14:06:55,846 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:06:56,491 - INFO - Authentication (publickey) successful!
-2024-12-14 14:06:56,504 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:08:56,873 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:09:50,054 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 14:09:50,054 - INFO - supporting data file UUID: 299611a7-6df9-4cdd-ada5-ae74e038f77c.
-2024-12-14 14:09:50,054 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVQZ.299611a7-6df9-4cdd-ada5-ae74e038f77c.chk.
-2024-12-14 14:09:50,054 - INFO - assuming na2_cc-pVQZ.299611a7-6df9-4cdd-ada5-ae74e038f77c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:09:50,054 - INFO - Analyzing task 620e9ff4-07bf-4767-9237-d39aa659b8e5...
-2024-12-14 14:09:50,054 - INFO - number of supporting files: 2
-2024-12-14 14:09:50,054 - INFO - supporting data file UUID: c288da42-cf53-4437-a310-24bf3e35e008.
-2024-12-14 14:09:50,054 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz.
-2024-12-14 14:09:50,054 - INFO - assuming fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz is an FCIDUMP file.
-2024-12-14 14:09:50,054 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz...
-2024-12-14 14:09:50,060 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:09:50,704 - INFO - Authentication (publickey) successful!
-2024-12-14 14:09:50,725 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:09:52,503 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:09:59,488 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 14:09:59,489 - INFO - supporting data file UUID: 74e99e36-315d-4e29-a4c9-2ae0b1c932d6.
-2024-12-14 14:09:59,489 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na2_cc-pVTZ.74e99e36-315d-4e29-a4c9-2ae0b1c932d6.chk.
-2024-12-14 14:09:59,489 - INFO - assuming na2_cc-pVTZ.74e99e36-315d-4e29-a4c9-2ae0b1c932d6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:09:59,490 - INFO - parsing ../problem_instances/problem_instance.mn_mono.cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8.json
-2024-12-14 14:09:59,491 - INFO - problem_instance UUID: cb40f3f7-ffe8-40e8-4544-f26aad5a8bd8
-2024-12-14 14:09:59,491 - INFO - problem_instance short name: mn_mono
-2024-12-14 14:09:59,491 - INFO - contains 8 associated Hamiltonians.
-2024-12-14 14:09:59,506 - INFO - Analyzing task de3ea361-c2d3-4ab6-add4-ccd43cea6aa8...
-2024-12-14 14:09:59,506 - INFO - number of supporting files: 1
-2024-12-14 14:09:59,506 - INFO - supporting data file UUID: 68af0b80-3d27-4aba-84f9-bcdd30a9255b.
-2024-12-14 14:09:59,506 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz.
-2024-12-14 14:09:59,506 - INFO - assuming fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz is an FCIDUMP file.
-2024-12-14 14:09:59,507 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz...
-2024-12-14 14:09:59,513 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:10:00,174 - INFO - Authentication (publickey) successful!
-2024-12-14 14:10:00,189 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:10:00,248 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:10:00,267 - INFO - ===============================================
-2024-12-14 14:10:00,267 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 14:10:12,065 - INFO - Circuit initialization time: 11.79833 seconds.
-2024-12-14 14:10:12,065 - INFO - Estimating logical resources...
-2024-12-14 14:10:15,496 - INFO - Resource estimation time (seconds): 3.430731
-2024-12-14 14:10:15,496 - INFO - Analyzing task 6c39d3a7-c71a-4049-a8c7-3a3a4b61d8da...
-2024-12-14 14:10:15,497 - INFO - number of supporting files: 1
-2024-12-14 14:10:15,497 - INFO - supporting data file UUID: 28a7820f-63fe-4920-aeec-a7ffe7e55d83.
-2024-12-14 14:10:15,497 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz.
-2024-12-14 14:10:15,497 - INFO - assuming fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz is an FCIDUMP file.
-2024-12-14 14:10:15,497 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz...
-2024-12-14 14:10:15,503 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:10:16,166 - INFO - Authentication (publickey) successful!
-2024-12-14 14:10:16,179 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:10:16,281 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:10:16,646 - INFO - ===============================================
-2024-12-14 14:10:16,646 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 462 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 14:14:12,695 - INFO - Circuit initialization time: 236.049405 seconds.
-2024-12-14 14:14:12,696 - INFO - Estimating logical resources...
-2024-12-14 14:14:36,461 - INFO - Resource estimation time (seconds): 23.764988
-2024-12-14 14:14:36,461 - INFO - Analyzing task 1ade03f3-06b1-4e95-b271-fea5a6343829...
-2024-12-14 14:14:36,461 - INFO - number of supporting files: 1
-2024-12-14 14:14:36,461 - INFO - supporting data file UUID: f738fcd6-7ddc-4d70-8ff9-4019e3718b04.
-2024-12-14 14:14:36,461 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz.
-2024-12-14 14:14:36,461 - INFO - assuming fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz is an FCIDUMP file.
-2024-12-14 14:14:36,461 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz...
-2024-12-14 14:14:36,465 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:14:37,130 - INFO - Authentication (publickey) successful!
-2024-12-14 14:14:37,144 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:14:37,198 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:14:37,217 - INFO - ===============================================
-2024-12-14 14:14:37,217 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 14:14:49,014 - INFO - Circuit initialization time: 11.796772 seconds.
-2024-12-14 14:14:49,014 - INFO - Estimating logical resources...
-2024-12-14 14:14:52,549 - INFO - Resource estimation time (seconds): 3.53481
-2024-12-14 14:14:52,549 - INFO - Analyzing task ff0da1e2-2c76-4589-aefa-c13bb1a1ef8f...
-2024-12-14 14:14:52,550 - INFO - number of supporting files: 1
-2024-12-14 14:14:52,550 - INFO - supporting data file UUID: 6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.
-2024-12-14 14:14:52,550 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz.
-2024-12-14 14:14:52,550 - INFO - assuming fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz is an FCIDUMP file.
-2024-12-14 14:14:52,550 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz...
-2024-12-14 14:14:52,555 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:14:53,259 - INFO - Authentication (publickey) successful!
-2024-12-14 14:14:53,273 - INFO - [chan 0] Opened sftp connection (server version 3)
-Downloading gsee/small_molecules/fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz to fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52.gz...
-Parsing fcidump.cl2_cc-pVDZ.8d4aaf5e-4bca-4e5b-9fb0-2556228f5c52
-Downloading gsee/small_molecules/fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz to fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a.gz...
-Parsing fcidump.cl2_cc-pVQZ.7b8c2dbd-8966-4eb4-83af-8acb07454e8a
-Downloading gsee/small_molecules/fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz to fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a.gz...
-Parsing fcidump.cl2_cc-pVTZ.781d0704-7a95-4183-9c50-cbdbd976884a
-Downloading gsee/small_molecules/fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz to fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258.gz...
-Parsing fcidump.Cu0_vdz.48434e2f-f09e-474e-b98c-af180386a258
-Downloading gsee/small_molecules/fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz to fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16.gz...
-Parsing fcidump.Cu0_vtz.e304b6b5-b820-470d-a8b5-92d6354abd16
-Downloading gsee/small_molecules/fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz to fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b.gz...
-Parsing fcidump.si2_h6_cc-pVDZ.bdb74fe0-4d88-4e9f-8354-7ff891c21b5b
-Downloading gsee/fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz to fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29.gz...
-Parsing fcidump.38_1_ts_noncan_0.2_new.46967cfc-d867-40e8-bef0-9655c46cef29
-Detected IPython. Loading juliacall extension. See https://juliapy.github.io/PythonCall.jl/stable/compat/#IPython
-Downloading gsee/fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz to fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5.gz...
-Parsing fcidump.39_1_ts_noncan_0.2_new.85d9d818-501e-4a0e-8fd8-c216ab5e3cb5
-Downloading gsee/fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz to fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b.gz...
-Parsing fcidump.40_1_ts_noncan_0.2_new.7db0f859-073f-46af-9325-016a67229a4b
-Downloading gsee/fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz to fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b.gz...
-Parsing fcidump.41_1_ts_noncan_0.2_new.2f0b6ced-7831-4fe0-b95e-ce4d456c9c6b
-Downloading gsee/fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz to fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae.gz...
-Parsing fcidump.42_1_star_noncan_0.2_new.a722dd32-93c7-4fbd-9cf5-f1bf44b2cdae
-Downloading gsee/fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz to fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437.gz...
-Parsing fcidump.43_1_star_noncan_0.2_new.d9707874-28d5-48b6-824e-a2e6c8753437
-Downloading gsee/fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz to fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac.gz...
-Parsing fcidump.44_1_star_noncan_0.2_new.727ab190-e399-4bb6-a9b3-20ae57789bac
-Downloading gsee/fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz to fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2.gz...
-Parsing fcidump.45_1_star_noncan_0.2_new.e986eb83-6b9d-439e-85ca-a9b931eef4a2
-Downloading gsee/fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz to fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234.gz...
-Parsing fcidump.46_2_noncan_0.2_new.6bf3207c-664b-4ed3-8e74-82b42e277234
-Downloading gsee/fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz to fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6.gz...
-Parsing fcidump.47_2_noncan_0.2_new.fb3ecfad-6450-423e-aa58-d5cddab6f0f6
-Downloading gsee/fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz to fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b.gz...
-Parsing fcidump.48_2_noncan_0.2_new.dc406285-bac1-4b99-afbf-06728b7d699b
-Downloading gsee/fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz to fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d.gz...
-Parsing fcidump.49_2_noncan_0.2_new.af9d6a83-7898-4c13-80eb-a83a533ebf2d
-Downloading gsee/FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz to FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697.gz...
-Parsing FCIDUMP_benzene_sto-3g_4c655f65-1899-469c-975a-a3caec750697
-Downloading gsee/FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz to FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850.gz...
-Parsing FCIDUMP_benzene_cc-pvdz_96ff0e22-a3ab-49f3-aee9-9a1886cbf850
-Downloading gsee/small_molecules/fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz to fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca.gz...
-Parsing fcidump.Cr1_vdz.69a1826c-1bee-4855-8f5f-5df29035bfca
-Downloading gsee/small_molecules/fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz to fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7.gz...
-Parsing fcidump.Cr1_vqz.4e3649dd-9050-4acc-93f6-a09c962e89d7
-Downloading gsee/small_molecules/fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz to fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010.gz...
-Parsing fcidump.Cr1_vtz.efaceb68-6fae-491a-bb90-1e3e3463f010
-Downloading gsee/small_molecules/fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz to fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc.gz...
-Parsing fcidump.Ti1_vdz.760e312c-9982-486d-b50e-d9acb003aedc
-Downloading gsee/small_molecules/fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz to fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9.gz...
-Parsing fcidump.Ti1_vtz.2ae865cc-f4c6-4e9f-903c-c8221e06b7a9
-Downloading gsee/small_molecules/fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz to fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a.gz...
-Parsing fcidump.V0_vdz.950e31e2-142f-480b-b0d1-174381bdb64a
-Downloading gsee/small_molecules/fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz to fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd.gz...
-Parsing fcidump.V0_vtz.d85e35e4-fe5c-4ea9-a5aa-d0273321a1dd
-Downloading gsee/small_molecules/fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz to fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab.gz...
-Parsing fcidump.CuO_vdz.da86aaff-3ca6-4d32-8da2-e1acfe6c31ab
-Downloading gsee/small_molecules/fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz to fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1.gz...
-Parsing fcidump.TiO_vdz.98719f34-8ba8-4557-a9fd-b28a84fe7dd1
-Downloading gsee/small_molecules/fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz to fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557.gz...
-Parsing fcidump.na2_cc-pVDZ.4ceb8edc-937e-4cb6-9e42-51b6760b2557
-Downloading gsee/small_molecules/fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz to fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d.gz...
-Parsing fcidump.na2_cc-pVQZ.4d93ba0f-4ad6-4107-b495-9284d226e13d
-Downloading gsee/small_molecules/fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz to fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008.gz...
-Parsing fcidump.na2_cc-pVTZ.c288da42-cf53-4437-a310-24bf3e35e008
-Downloading gsee/fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz to fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b.gz...
-Parsing fcidump.59_5_16_noncan_0.2_new.68af0b80-3d27-4aba-84f9-bcdd30a9255b
-Downloading gsee/fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz to fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83.gz...
-Parsing fcidump.60_5_16_noncan_0.2_new.28a7820f-63fe-4920-aeec-a7ffe7e55d83
-Downloading gsee/fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz to fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04.gz...
-Parsing fcidump.61_3_15_af_noncan_0.2_new.f738fcd6-7ddc-4d70-8ff9-4019e3718b04
-2024-12-14 14:14:53,355 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:14:53,758 - INFO - ===============================================
-2024-12-14 14:14:53,758 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 14:19:24,730 - INFO - Circuit initialization time: 270.972011 seconds.
-2024-12-14 14:19:24,730 - INFO - Estimating logical resources...
-2024-12-14 14:19:58,174 - INFO - Resource estimation time (seconds): 33.444072
-2024-12-14 14:19:58,174 - INFO - Analyzing task a9c90f98-6557-44d2-9ca0-0c9122f4080c...
-2024-12-14 14:19:58,174 - INFO - number of supporting files: 1
-2024-12-14 14:19:58,174 - INFO - supporting data file UUID: 027490ba-34f9-4340-89ab-27fd110d2821.
-2024-12-14 14:19:58,174 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz.
-2024-12-14 14:19:58,175 - INFO - assuming fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz is an FCIDUMP file.
-2024-12-14 14:19:58,175 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz...
-2024-12-14 14:19:58,181 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:19:58,661 - INFO - Authentication (publickey) successful!
-2024-12-14 14:19:58,680 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:19:58,742 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:19:58,770 - INFO - ===============================================
-2024-12-14 14:19:58,770 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 14:20:08,448 - INFO - Circuit initialization time: 9.677917 seconds.
-2024-12-14 14:20:08,448 - INFO - Estimating logical resources...
-2024-12-14 14:20:11,931 - INFO - Resource estimation time (seconds): 3.482612
-2024-12-14 14:20:11,931 - INFO - Analyzing task a16168e2-98cd-430d-a180-84f64b4d5e75...
-2024-12-14 14:20:11,931 - INFO - number of supporting files: 1
-2024-12-14 14:20:11,931 - INFO - supporting data file UUID: bae2da57-6a69-483e-95bc-b77f72ebfba8.
-2024-12-14 14:20:11,931 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz.
-2024-12-14 14:20:11,931 - INFO - assuming fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz is an FCIDUMP file.
-2024-12-14 14:20:11,931 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz...
-2024-12-14 14:20:11,936 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:20:12,591 - INFO - Authentication (publickey) successful!
-2024-12-14 14:20:12,604 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:20:12,687 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:20:13,096 - INFO - ===============================================
-2024-12-14 14:20:13,097 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 14:24:44,300 - INFO - Circuit initialization time: 271.203765 seconds.
-2024-12-14 14:24:44,301 - INFO - Estimating logical resources...
-2024-12-14 14:25:22,989 - INFO - Resource estimation time (seconds): 38.688265
-2024-12-14 14:25:22,989 - INFO - Analyzing task 590c2f0b-964b-4d09-96ad-101a9be59cab...
-2024-12-14 14:25:22,989 - INFO - number of supporting files: 1
-2024-12-14 14:25:22,989 - INFO - supporting data file UUID: 72343006-774e-4192-b481-fa840ed25573.
-2024-12-14 14:25:22,989 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz.
-2024-12-14 14:25:22,989 - INFO - assuming fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz is an FCIDUMP file.
-2024-12-14 14:25:22,990 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz...
-2024-12-14 14:25:22,995 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:25:23,661 - INFO - Authentication (publickey) successful!
-2024-12-14 14:25:23,680 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:25:23,732 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:25:23,752 - INFO - ===============================================
-2024-12-14 14:25:23,752 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 14:25:34,909 - INFO - Circuit initialization time: 11.156407 seconds.
-2024-12-14 14:25:34,909 - INFO - Estimating logical resources...
-2024-12-14 14:25:38,217 - INFO - Resource estimation time (seconds): 3.308036
-2024-12-14 14:25:38,217 - INFO - Analyzing task 6e617348-d0b3-4b6d-9923-ea54ba5cf751...
-2024-12-14 14:25:38,217 - INFO - number of supporting files: 1
-2024-12-14 14:25:38,217 - INFO - supporting data file UUID: ea55abec-8253-445d-85fa-914948b5e5a5.
-2024-12-14 14:25:38,217 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz.
-2024-12-14 14:25:38,217 - INFO - assuming fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz is an FCIDUMP file.
-2024-12-14 14:25:38,217 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz...
-2024-12-14 14:25:38,224 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:25:38,879 - INFO - Authentication (publickey) successful!
-2024-12-14 14:25:38,895 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:25:38,990 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:25:39,403 - INFO - ===============================================
-2024-12-14 14:25:39,403 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 494 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 14:30:14,435 - INFO - Circuit initialization time: 275.031716 seconds.
-2024-12-14 14:30:14,435 - INFO - Estimating logical resources...
-2024-12-14 14:30:53,422 - INFO - Resource estimation time (seconds): 38.986343
-2024-12-14 14:30:53,425 - INFO - parsing ../problem_instances/problem_instance.FeO_0.55d0ed82-0560-4448-8459-c2ba00654d9d.json
-2024-12-14 14:30:53,425 - INFO - problem_instance UUID: 55d0ed82-0560-4448-8459-c2ba00654d9d
-2024-12-14 14:30:53,425 - INFO - problem_instance short name: FeO_0
-2024-12-14 14:30:53,425 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:30:53,442 - INFO - Analyzing task b8344eb5-f574-4198-b917-8312240ba288...
-2024-12-14 14:30:53,442 - INFO - number of supporting files: 2
-2024-12-14 14:30:53,442 - INFO - supporting data file UUID: 3f1777dc-c493-4aa7-b3d1-6271d9bed459.
-2024-12-14 14:30:53,442 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz.
-2024-12-14 14:30:53,442 - INFO - assuming fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz is an FCIDUMP file.
-2024-12-14 14:30:53,442 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz...
-2024-12-14 14:30:53,447 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:30:54,092 - INFO - Authentication (publickey) successful!
-2024-12-14 14:30:54,107 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:31:00,775 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:31:14,070 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 14:31:14,070 - INFO - supporting data file UUID: 8bb3298d-0a60-4249-bfc5-94f399fbd522.
-2024-12-14 14:31:14,070 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/FeO_vdz.8bb3298d-0a60-4249-bfc5-94f399fbd522.chk.
-2024-12-14 14:31:14,070 - INFO - assuming FeO_vdz.8bb3298d-0a60-4249-bfc5-94f399fbd522.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:31:14,074 - INFO - parsing ../problem_instances/problem_instance.p_h3_0.0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57.json
-2024-12-14 14:31:14,074 - INFO - problem_instance UUID: 0c2e43eb-58f3-41ca-a21f-ae46fc2a0e57
-2024-12-14 14:31:14,074 - INFO - problem_instance short name: p_h3_0
-2024-12-14 14:31:14,074 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:31:14,089 - INFO - Analyzing task af399f2b-a4f8-4fec-aca2-7c126ed989a5...
-2024-12-14 14:31:14,090 - INFO - number of supporting files: 2
-2024-12-14 14:31:14,090 - INFO - supporting data file UUID: 7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.
-2024-12-14 14:31:14,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz.
-2024-12-14 14:31:14,090 - INFO - assuming fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz is an FCIDUMP file.
-2024-12-14 14:31:14,090 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz...
-2024-12-14 14:31:14,095 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:31:14,753 - INFO - Authentication (publickey) successful!
-2024-12-14 14:31:14,767 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:31:14,932 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:31:15,949 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 14:31:15,950 - INFO - supporting data file UUID: e7dafb07-2975-4414-9924-2f8037778aee.
-2024-12-14 14:31:15,950 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p_h3_cc-pVDZ.e7dafb07-2975-4414-9924-2f8037778aee.chk.
-2024-12-14 14:31:15,950 - INFO - assuming p_h3_cc-pVDZ.e7dafb07-2975-4414-9924-2f8037778aee.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:31:15,950 - INFO - Analyzing task 819ff18a-5aad-46df-83ef-bd209e44936b...
-2024-12-14 14:31:15,950 - INFO - number of supporting files: 2
-2024-12-14 14:31:15,950 - INFO - supporting data file UUID: 2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.
-2024-12-14 14:31:15,950 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz.
-2024-12-14 14:31:15,950 - INFO - assuming fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz is an FCIDUMP file.
-2024-12-14 14:31:15,950 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz...
-2024-12-14 14:31:15,957 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:31:16,609 - INFO - Authentication (publickey) successful!
-2024-12-14 14:31:16,624 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:31:44,579 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:32:11,420 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 14:32:11,420 - INFO - supporting data file UUID: b8c794eb-a077-4227-9777-80462e7beefd.
-2024-12-14 14:32:11,420 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p_h3_cc-pVTZ.b8c794eb-a077-4227-9777-80462e7beefd.chk.
-2024-12-14 14:32:11,420 - INFO - assuming p_h3_cc-pVTZ.b8c794eb-a077-4227-9777-80462e7beefd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:32:11,424 - INFO - parsing ../problem_instances/problem_instance.h2_s_0.208f2e50-2b56-4e72-815a-cba5cec1264c.json
-2024-12-14 14:32:11,424 - INFO - problem_instance UUID: 208f2e50-2b56-4e72-815a-cba5cec1264c
-2024-12-14 14:32:11,424 - INFO - problem_instance short name: h2_s_0
-2024-12-14 14:32:11,424 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:32:11,440 - INFO - Analyzing task f2f09d9f-8328-4d4a-ba91-089f9e56bf0d...
-2024-12-14 14:32:11,440 - INFO - number of supporting files: 2
-2024-12-14 14:32:11,440 - INFO - supporting data file UUID: 11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.
-2024-12-14 14:32:11,440 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz.
-2024-12-14 14:32:11,440 - INFO - assuming fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz is an FCIDUMP file.
-2024-12-14 14:32:11,440 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz...
-2024-12-14 14:32:11,447 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:32:12,103 - INFO - Authentication (publickey) successful!
-2024-12-14 14:32:12,120 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:32:12,210 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:32:12,462 - INFO - ===============================================
-2024-12-14 14:32:12,462 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 280 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 281 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 283 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 286 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 287 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 291 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 292 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 293 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 294 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 295 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 296 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 298 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 299 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 301 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 302 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 303 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 304 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 305 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 306 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 307 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 308 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 309 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 310 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 311 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 312 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 313 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 314 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 14:33:30,843 - INFO - Circuit initialization time: 78.380456 seconds.
-2024-12-14 14:33:30,843 - INFO - Estimating logical resources...
-2024-12-14 14:33:48,135 - INFO - Resource estimation time (seconds): 17.291935
-2024-12-14 14:33:48,135 - INFO - supporting data file UUID: b28fc567-776a-49e9-b537-f885125f2e41.
-2024-12-14 14:33:48,136 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVDZ.b28fc567-776a-49e9-b537-f885125f2e41.chk.
-2024-12-14 14:33:48,136 - INFO - assuming h2_s_cc-pVDZ.b28fc567-776a-49e9-b537-f885125f2e41.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:33:48,136 - INFO - Analyzing task 3d5186f9-82b3-4de0-9bc1-242d7bdb678a...
-2024-12-14 14:33:48,136 - INFO - number of supporting files: 2
-2024-12-14 14:33:48,136 - INFO - supporting data file UUID: 57afbbf8-5819-4ee7-b540-95974b8a1a3f.
-2024-12-14 14:33:48,136 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz.
-2024-12-14 14:33:48,136 - INFO - assuming fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz is an FCIDUMP file.
-2024-12-14 14:33:48,136 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz...
-2024-12-14 14:33:48,141 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:33:48,805 - INFO - Authentication (publickey) successful!
-2024-12-14 14:33:48,834 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:36:17,156 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:37:18,793 - INFO - Skipping Logical Resource Estimate because number of orbitals (119) exceeds maximum specified in config (32).
-2024-12-14 14:37:18,794 - INFO - supporting data file UUID: 6474909a-c9c8-4e8b-be9c-71207ece21ea.
-2024-12-14 14:37:18,794 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVQZ.6474909a-c9c8-4e8b-be9c-71207ece21ea.chk.
-2024-12-14 14:37:18,794 - INFO - assuming h2_s_cc-pVQZ.6474909a-c9c8-4e8b-be9c-71207ece21ea.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:37:18,794 - INFO - Analyzing task ec0baf59-05f5-49df-b5e5-8f887d822a10...
-2024-12-14 14:37:18,794 - INFO - number of supporting files: 2
-2024-12-14 14:37:18,794 - INFO - supporting data file UUID: 83f0f242-e184-4581-a77a-f019731d8a6f.
-2024-12-14 14:37:18,794 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz.
-2024-12-14 14:37:18,794 - INFO - assuming fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz is an FCIDUMP file.
-2024-12-14 14:37:18,794 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz...
-2024-12-14 14:37:18,799 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:37:19,335 - INFO - Authentication (publickey) successful!
-2024-12-14 14:37:19,350 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:37:20,566 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:37:25,238 - INFO - Skipping Logical Resource Estimate because number of orbitals (62) exceeds maximum specified in config (32).
-2024-12-14 14:37:25,238 - INFO - supporting data file UUID: 2081f24a-d7ea-452a-b9bc-9901d06282d6.
-2024-12-14 14:37:25,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_s_cc-pVTZ.2081f24a-d7ea-452a-b9bc-9901d06282d6.chk.
-2024-12-14 14:37:25,239 - INFO - assuming h2_s_cc-pVTZ.2081f24a-d7ea-452a-b9bc-9901d06282d6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:37:25,244 - INFO - parsing ../problem_instances/problem_instance.Sc_0.67f72316-2262-44fb-8c0a-e159e1cd0cf0.json
-2024-12-14 14:37:25,245 - INFO - problem_instance UUID: 67f72316-2262-44fb-8c0a-e159e1cd0cf0
-2024-12-14 14:37:25,245 - INFO - problem_instance short name: Sc_0
-2024-12-14 14:37:25,245 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:37:25,262 - INFO - Analyzing task fb87d637-aaab-4e8f-8898-4ecca8bd0fe0...
-2024-12-14 14:37:25,262 - INFO - number of supporting files: 2
-2024-12-14 14:37:25,262 - INFO - supporting data file UUID: 9da0b1fb-c6a5-4da5-b390-3920e3c26154.
-2024-12-14 14:37:25,262 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz.
-2024-12-14 14:37:25,262 - INFO - assuming fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz is an FCIDUMP file.
-2024-12-14 14:37:25,262 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz...
-2024-12-14 14:37:25,267 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:37:25,932 - INFO - Authentication (publickey) successful!
-2024-12-14 14:37:25,952 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:37:26,413 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:37:29,388 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 14:37:29,388 - INFO - supporting data file UUID: 11066a5f-4cab-41ed-9bcf-bc34a77d52c6.
-2024-12-14 14:37:29,388 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vdz.11066a5f-4cab-41ed-9bcf-bc34a77d52c6.chk.
-2024-12-14 14:37:29,388 - INFO - assuming Sc0_vdz.11066a5f-4cab-41ed-9bcf-bc34a77d52c6.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:37:29,389 - INFO - Analyzing task 96c6a0d7-8a1e-4189-a934-833b80ade346...
-2024-12-14 14:37:29,389 - INFO - number of supporting files: 2
-2024-12-14 14:37:29,389 - INFO - supporting data file UUID: 85c6b46a-59fe-4506-89d3-e6faec2383e2.
-2024-12-14 14:37:29,389 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz.
-2024-12-14 14:37:29,389 - INFO - assuming fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz is an FCIDUMP file.
-2024-12-14 14:37:29,389 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz...
-2024-12-14 14:37:29,393 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:37:30,043 - INFO - Authentication (publickey) successful!
-2024-12-14 14:37:30,059 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:41:03,703 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:42:18,747 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-14 14:42:18,747 - INFO - supporting data file UUID: 814f1b4d-2820-4c3f-8367-05f604deee43.
-2024-12-14 14:42:18,747 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vqz.814f1b4d-2820-4c3f-8367-05f604deee43.chk.
-2024-12-14 14:42:18,748 - INFO - assuming Sc0_vqz.814f1b4d-2820-4c3f-8367-05f604deee43.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:42:18,748 - INFO - Analyzing task dc1da839-0ccc-434c-bf9c-a3874ffc3b1c...
-2024-12-14 14:42:18,748 - INFO - number of supporting files: 2
-2024-12-14 14:42:18,748 - INFO - supporting data file UUID: 83008296-5ec9-4af7-a03b-372025fad080.
-2024-12-14 14:42:18,748 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz.
-2024-12-14 14:42:18,748 - INFO - assuming fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz is an FCIDUMP file.
-2024-12-14 14:42:18,748 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz...
-2024-12-14 14:42:18,753 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:42:19,396 - INFO - Authentication (publickey) successful!
-2024-12-14 14:42:19,410 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:42:25,914 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:42:38,965 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:42:38,965 - INFO - supporting data file UUID: 0a3909ae-25ab-4fd7-8625-12a477404329.
-2024-12-14 14:42:38,965 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc0_vtz.0a3909ae-25ab-4fd7-8625-12a477404329.chk.
-2024-12-14 14:42:38,965 - INFO - assuming Sc0_vtz.0a3909ae-25ab-4fd7-8625-12a477404329.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:42:38,971 - INFO - parsing ../problem_instances/problem_instance.na_cl_0.3f141f05-532b-478d-b38a-2ae07baadc88.json
-2024-12-14 14:42:38,971 - INFO - problem_instance UUID: 3f141f05-532b-478d-b38a-2ae07baadc88
-2024-12-14 14:42:38,971 - INFO - problem_instance short name: na_cl_0
-2024-12-14 14:42:38,971 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:42:38,987 - INFO - Analyzing task da831b60-89ce-4c01-96f9-c9f8a4512aab...
-2024-12-14 14:42:38,987 - INFO - number of supporting files: 2
-2024-12-14 14:42:38,987 - INFO - supporting data file UUID: cd31956d-bef5-4112-9959-510170644e72.
-2024-12-14 14:42:38,987 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz.
-2024-12-14 14:42:38,987 - INFO - assuming fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz is an FCIDUMP file.
-2024-12-14 14:42:38,987 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz...
-2024-12-14 14:42:38,997 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:42:39,654 - INFO - Authentication (publickey) successful!
-2024-12-14 14:42:39,676 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:42:39,782 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:42:40,455 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 14:42:40,455 - INFO - supporting data file UUID: 54f78447-2f62-48c7-a584-037808c4e08c.
-2024-12-14 14:42:40,456 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVDZ.54f78447-2f62-48c7-a584-037808c4e08c.chk.
-2024-12-14 14:42:40,456 - INFO - assuming na_cl_cc-pVDZ.54f78447-2f62-48c7-a584-037808c4e08c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:42:40,456 - INFO - Analyzing task a2f9649f-0f47-4a5d-a6a7-b0bebc848797...
-2024-12-14 14:42:40,456 - INFO - number of supporting files: 2
-2024-12-14 14:42:40,456 - INFO - supporting data file UUID: 677d97ee-5a46-4d49-82d6-ca3fc98a59a7.
-2024-12-14 14:42:40,456 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz.
-2024-12-14 14:42:40,456 - INFO - assuming fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz is an FCIDUMP file.
-2024-12-14 14:42:40,456 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz...
-2024-12-14 14:42:40,471 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:42:40,966 - INFO - Authentication (publickey) successful!
-2024-12-14 14:42:40,982 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:45:12,201 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:18,873 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 14:46:18,874 - INFO - supporting data file UUID: fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.
-2024-12-14 14:46:18,874 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVQZ.fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.chk.
-2024-12-14 14:46:18,874 - INFO - assuming na_cl_cc-pVQZ.fc236ca4-1327-4ca6-97a1-1140fd3f6e5a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:46:18,874 - INFO - Analyzing task 01ec60f7-d38a-4c33-a498-659a388e10ee...
-2024-12-14 14:46:18,874 - INFO - number of supporting files: 2
-2024-12-14 14:46:18,874 - INFO - supporting data file UUID: 444f3f27-904b-463f-b2f2-c92686c9637d.
-2024-12-14 14:46:18,874 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz.
-2024-12-14 14:46:18,874 - INFO - assuming fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz is an FCIDUMP file.
-2024-12-14 14:46:18,874 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz...
-2024-12-14 14:46:18,881 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:46:19,542 - INFO - Authentication (publickey) successful!
-2024-12-14 14:46:19,555 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:46:21,936 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:30,409 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 14:46:30,409 - INFO - supporting data file UUID: 0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.
-2024-12-14 14:46:30,409 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/na_cl_cc-pVTZ.0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.chk.
-2024-12-14 14:46:30,410 - INFO - assuming na_cl_cc-pVTZ.0a9b8f1f-bdb0-4fd4-b9c5-724d4783d7af.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:46:30,412 - INFO - parsing ../problem_instances/problem_instance.c2_h2_0.0ca102a7-dad4-4d42-8c73-9acfa45378d7.json
-2024-12-14 14:46:30,413 - INFO - problem_instance UUID: 0ca102a7-dad4-4d42-8c73-9acfa45378d7
-2024-12-14 14:46:30,413 - INFO - problem_instance short name: c2_h2_0
-2024-12-14 14:46:30,413 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:46:30,428 - INFO - Analyzing task 2761e36e-f001-42af-8086-f507b5643ec8...
-2024-12-14 14:46:30,428 - INFO - number of supporting files: 2
-2024-12-14 14:46:30,428 - INFO - supporting data file UUID: 5b507b3d-b6fc-4e13-9586-06113819d99f.
-2024-12-14 14:46:30,428 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz.
-2024-12-14 14:46:30,428 - INFO - assuming fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz is an FCIDUMP file.
-2024-12-14 14:46:30,428 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz...
-2024-12-14 14:46:30,433 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:46:31,063 - INFO - Authentication (publickey) successful!
-2024-12-14 14:46:31,080 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:46:31,192 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:31,806 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 14:46:31,806 - INFO - supporting data file UUID: 7d37092e-ec2a-4cc0-b18a-211e358f2a3d.
-2024-12-14 14:46:31,806 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h2_cc-pVDZ.7d37092e-ec2a-4cc0-b18a-211e358f2a3d.chk.
-2024-12-14 14:46:31,806 - INFO - assuming c2_h2_cc-pVDZ.7d37092e-ec2a-4cc0-b18a-211e358f2a3d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:46:31,806 - INFO - Analyzing task b1352b0c-aa96-4f58-a0e2-356d3c43c8a1...
-2024-12-14 14:46:31,806 - INFO - number of supporting files: 2
-2024-12-14 14:46:31,806 - INFO - supporting data file UUID: 57793481-c847-4746-8241-ea949add5f87.
-2024-12-14 14:46:31,806 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz.
-2024-12-14 14:46:31,806 - INFO - assuming fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz is an FCIDUMP file.
-2024-12-14 14:46:31,806 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz...
-2024-12-14 14:46:31,812 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:46:32,877 - INFO - Authentication (publickey) successful!
-2024-12-14 14:46:32,901 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:46:42,176 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:57,552 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:46:57,552 - INFO - supporting data file UUID: f6d434e3-5c53-44f3-80ac-da5e7851f45a.
-2024-12-14 14:46:57,552 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h2_cc-pVTZ.f6d434e3-5c53-44f3-80ac-da5e7851f45a.chk.
-2024-12-14 14:46:57,552 - INFO - assuming c2_h2_cc-pVTZ.f6d434e3-5c53-44f3-80ac-da5e7851f45a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:46:57,558 - INFO - parsing ../problem_instances/problem_instance.li_f_0.e48e7467-1fcd-478b-a599-f4ce881c57b9.json
-2024-12-14 14:46:57,558 - INFO - problem_instance UUID: e48e7467-1fcd-478b-a599-f4ce881c57b9
-2024-12-14 14:46:57,558 - INFO - problem_instance short name: li_f_0
-2024-12-14 14:46:57,558 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 14:46:57,575 - INFO - Analyzing task 80043b93-039c-4d5a-abcb-84b8f25f7abb...
-2024-12-14 14:46:57,575 - INFO - number of supporting files: 2
-2024-12-14 14:46:57,575 - INFO - supporting data file UUID: 19cf5a4d-e90f-4ab1-a062-b20089724a63.
-2024-12-14 14:46:57,575 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz.
-2024-12-14 14:46:57,575 - INFO - assuming fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz is an FCIDUMP file.
-2024-12-14 14:46:57,575 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz...
-2024-12-14 14:46:57,581 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:46:58,239 - INFO - Authentication (publickey) successful!
-2024-12-14 14:46:58,253 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:46:58,333 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:46:58,603 - INFO - ===============================================
-2024-12-14 14:46:58,603 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 294 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 299 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 301 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 304 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 305 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 308 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 309 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 310 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 311 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 312 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 313 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 314 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 320 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 321 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 322 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 323 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 324 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 325 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 326 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 14:48:43,432 - INFO - Circuit initialization time: 104.829323 seconds.
-2024-12-14 14:48:43,432 - INFO - Estimating logical resources...
-2024-12-14 14:48:59,893 - INFO - Resource estimation time (seconds): 16.460609
-2024-12-14 14:48:59,893 - INFO - supporting data file UUID: e04452b6-2617-4dd7-a493-1d3e5e02639a.
-2024-12-14 14:48:59,893 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVDZ.e04452b6-2617-4dd7-a493-1d3e5e02639a.chk.
-2024-12-14 14:48:59,893 - INFO - assuming li_f_cc-pVDZ.e04452b6-2617-4dd7-a493-1d3e5e02639a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:48:59,894 - INFO - Analyzing task 0485949f-722c-49ee-a748-eec54801f021...
-2024-12-14 14:48:59,894 - INFO - number of supporting files: 2
-2024-12-14 14:48:59,894 - INFO - supporting data file UUID: 2294b211-7a05-445e-810d-4c1706e1444c.
-2024-12-14 14:48:59,894 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz.
-2024-12-14 14:48:59,894 - INFO - assuming fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz is an FCIDUMP file.
-2024-12-14 14:48:59,894 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz...
-2024-12-14 14:48:59,899 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:49:00,532 - INFO - Authentication (publickey) successful!
-2024-12-14 14:49:00,547 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:50:29,176 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:17,238 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 14:51:17,239 - INFO - supporting data file UUID: e2d31834-f73d-46a0-ba41-fa67b298611c.
-2024-12-14 14:51:17,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVQZ.e2d31834-f73d-46a0-ba41-fa67b298611c.chk.
-2024-12-14 14:51:17,239 - INFO - assuming li_f_cc-pVQZ.e2d31834-f73d-46a0-ba41-fa67b298611c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:51:17,239 - INFO - Analyzing task b80345ff-5df9-4fb3-86ab-0a25188b296d...
-2024-12-14 14:51:17,239 - INFO - number of supporting files: 2
-2024-12-14 14:51:17,239 - INFO - supporting data file UUID: c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.
-2024-12-14 14:51:17,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz.
-2024-12-14 14:51:17,240 - INFO - assuming fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz is an FCIDUMP file.
-2024-12-14 14:51:17,240 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz...
-2024-12-14 14:51:17,245 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:51:17,929 - INFO - Authentication (publickey) successful!
-2024-12-14 14:51:17,948 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:51:19,273 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:24,143 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 14:51:24,144 - INFO - supporting data file UUID: b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.
-2024-12-14 14:51:24,144 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_f_cc-pVTZ.b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.chk.
-2024-12-14 14:51:24,144 - INFO - assuming li_f_cc-pVTZ.b2aa1a42-9ae2-4fb8-b947-725b7cfe1124.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:51:24,146 - INFO - parsing ../problem_instances/problem_instance.h2_c_o_0.25fd617b-8e7f-4422-9e97-cc3f6b0d3876.json
-2024-12-14 14:51:24,146 - INFO - problem_instance UUID: 25fd617b-8e7f-4422-9e97-cc3f6b0d3876
-2024-12-14 14:51:24,146 - INFO - problem_instance short name: h2_c_o_0
-2024-12-14 14:51:24,146 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:51:24,165 - INFO - Analyzing task d58cb72b-e144-4164-aec0-309aaef6394c...
-2024-12-14 14:51:24,165 - INFO - number of supporting files: 2
-2024-12-14 14:51:24,165 - INFO - supporting data file UUID: d3d8851e-f3df-490c-975a-467933bd9fa1.
-2024-12-14 14:51:24,165 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz.
-2024-12-14 14:51:24,165 - INFO - assuming fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz is an FCIDUMP file.
-2024-12-14 14:51:24,165 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz...
-2024-12-14 14:51:24,170 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:51:24,815 - INFO - Authentication (publickey) successful!
-2024-12-14 14:51:24,830 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:51:24,943 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:25,473 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 14:51:25,473 - INFO - supporting data file UUID: 25a78420-0b29-4de5-acdc-104aa0f0b9fb.
-2024-12-14 14:51:25,473 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_c_o_cc-pVDZ.25a78420-0b29-4de5-acdc-104aa0f0b9fb.chk.
-2024-12-14 14:51:25,473 - INFO - assuming h2_c_o_cc-pVDZ.25a78420-0b29-4de5-acdc-104aa0f0b9fb.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:51:25,473 - INFO - Analyzing task ed09e1bf-40f3-4bf0-b9c7-7bb1990c5cae...
-2024-12-14 14:51:25,473 - INFO - number of supporting files: 2
-2024-12-14 14:51:25,473 - INFO - supporting data file UUID: f1c78add-0e23-423a-bb96-f1370626aa47.
-2024-12-14 14:51:25,473 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz.
-2024-12-14 14:51:25,474 - INFO - assuming fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz is an FCIDUMP file.
-2024-12-14 14:51:25,474 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz...
-2024-12-14 14:51:25,479 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:51:26,131 - INFO - Authentication (publickey) successful!
-2024-12-14 14:51:26,144 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:51:33,254 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:47,050 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:51:47,051 - INFO - supporting data file UUID: 30bd24e2-947b-4917-89bb-8bdb17406ff5.
-2024-12-14 14:51:47,051 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_c_o_cc-pVTZ.30bd24e2-947b-4917-89bb-8bdb17406ff5.chk.
-2024-12-14 14:51:47,051 - INFO - assuming h2_c_o_cc-pVTZ.30bd24e2-947b-4917-89bb-8bdb17406ff5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:51:47,059 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0011.766ba2da-e72a-4e03-a739-f97269026fc4.json
-2024-12-14 14:51:47,059 - INFO - problem_instance UUID: 766ba2da-e72a-4e03-a739-f97269026fc4
-2024-12-14 14:51:47,059 - INFO - problem_instance short name: planted_solution_0011
-2024-12-14 14:51:47,059 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:51:47,075 - INFO - Analyzing task 0021e256-8e13-42db-839d-e9155e8af82c...
-2024-12-14 14:51:47,075 - INFO - number of supporting files: 1
-2024-12-14 14:51:47,075 - INFO - supporting data file UUID: befcf6f0-cfcb-49b7-b661-de48ad8a44c8.
-2024-12-14 14:51:47,075 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz.
-2024-12-14 14:51:47,075 - INFO - assuming fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz is an FCIDUMP file.
-2024-12-14 14:51:47,075 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz...
-2024-12-14 14:51:47,081 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:51:47,737 - INFO - Authentication (publickey) successful!
-2024-12-14 14:51:47,754 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:51:47,855 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:51:48,216 - INFO - ===============================================
-2024-12-14 14:51:48,216 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 85 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 88 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 90 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 91 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 92 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 93 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 94 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 95 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 96 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 97 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 98 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 99 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 100 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 14:55:04,982 - INFO - Circuit initialization time: 196.765987 seconds.
-2024-12-14 14:55:04,982 - INFO - Estimating logical resources...
-2024-12-14 14:55:11,339 - INFO - Resource estimation time (seconds): 6.356602
-2024-12-14 14:55:11,341 - INFO - parsing ../problem_instances/problem_instance.Mn_0.bc202949-d76c-4962-b937-5c12b298b8b4.json
-2024-12-14 14:55:11,341 - INFO - problem_instance UUID: bc202949-d76c-4962-b937-5c12b298b8b4
-2024-12-14 14:55:11,341 - INFO - problem_instance short name: Mn_0
-2024-12-14 14:55:11,341 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 14:55:11,357 - INFO - Analyzing task 289f5dfe-e6d5-48a3-a6ae-25088321d3c6...
-2024-12-14 14:55:11,357 - INFO - number of supporting files: 2
-2024-12-14 14:55:11,357 - INFO - supporting data file UUID: a83413fb-96e3-466e-910b-6d4bab7cdf1d.
-2024-12-14 14:55:11,357 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz.
-2024-12-14 14:55:11,357 - INFO - assuming fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz is an FCIDUMP file.
-2024-12-14 14:55:11,357 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz...
-2024-12-14 14:55:11,362 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:55:12,035 - INFO - Authentication (publickey) successful!
-2024-12-14 14:55:12,055 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:55:13,266 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:55:18,445 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 14:55:18,445 - INFO - supporting data file UUID: da9344cd-a191-40aa-a0bd-726e7200facf.
-2024-12-14 14:55:18,445 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn0_vdz.da9344cd-a191-40aa-a0bd-726e7200facf.chk.
-2024-12-14 14:55:18,446 - INFO - assuming Mn0_vdz.da9344cd-a191-40aa-a0bd-726e7200facf.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:55:18,446 - INFO - Analyzing task 24f12fad-130e-44fc-8b07-bc26c5a3d878...
-2024-12-14 14:55:18,446 - INFO - number of supporting files: 2
-2024-12-14 14:55:18,446 - INFO - supporting data file UUID: 07c9da30-e172-4183-a8af-301628b75f1c.
-2024-12-14 14:55:18,446 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz.
-2024-12-14 14:55:18,446 - INFO - assuming fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz is an FCIDUMP file.
-2024-12-14 14:55:18,446 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz...
-2024-12-14 14:55:18,450 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:55:19,100 - INFO - Authentication (publickey) successful!
-2024-12-14 14:55:19,117 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:56:52,433 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:57:41,426 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 14:57:41,426 - INFO - supporting data file UUID: 2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.
-2024-12-14 14:57:41,426 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn0_vtz.2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.chk.
-2024-12-14 14:57:41,426 - INFO - assuming Mn0_vtz.2efdaa8a-b0d9-4b60-b92c-7fb4d0864132.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 14:57:41,435 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0008.b57eb979-5c09-4974-97b4-5862e109a1ae.json
-2024-12-14 14:57:41,436 - INFO - problem_instance UUID: b57eb979-5c09-4974-97b4-5862e109a1ae
-2024-12-14 14:57:41,436 - INFO - problem_instance short name: planted_solution_0008
-2024-12-14 14:57:41,436 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 14:57:41,456 - INFO - Analyzing task af56de36-35aa-44b9-8eb7-b9c1e8f7d0f3...
-2024-12-14 14:57:41,456 - INFO - number of supporting files: 1
-2024-12-14 14:57:41,456 - INFO - supporting data file UUID: 44060124-8f2d-4a91-80a9-5a29f0f4f716.
-2024-12-14 14:57:41,456 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz.
-2024-12-14 14:57:41,456 - INFO - assuming fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz is an FCIDUMP file.
-2024-12-14 14:57:41,456 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz...
-2024-12-14 14:57:41,461 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:57:42,103 - INFO - Authentication (publickey) successful!
-2024-12-14 14:57:42,120 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:57:42,187 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:57:42,204 - INFO - ===============================================
-2024-12-14 14:57:42,204 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 14:57:51,758 - INFO - Circuit initialization time: 9.554496 seconds.
-2024-12-14 14:57:51,758 - INFO - Estimating logical resources...
-2024-12-14 14:57:53,288 - INFO - Resource estimation time (seconds): 1.529733
-2024-12-14 14:57:53,290 - INFO - parsing ../problem_instances/problem_instance.mo_n2.664ec8e4-09d5-41cc-6266-ddb26219366f.json
-2024-12-14 14:57:53,291 - INFO - problem_instance UUID: 664ec8e4-09d5-41cc-6266-ddb26219366f
-2024-12-14 14:57:53,291 - INFO - problem_instance short name: mo_n2
-2024-12-14 14:57:53,291 - INFO - contains 4 associated Hamiltonians.
-2024-12-14 14:57:53,306 - INFO - Analyzing task 00ba4917-d66a-4335-819f-43390dfc9929...
-2024-12-14 14:57:53,306 - INFO - number of supporting files: 1
-2024-12-14 14:57:53,306 - INFO - supporting data file UUID: 23aa47ca-9afe-4086-bd97-75de310e033e.
-2024-12-14 14:57:53,306 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz.
-2024-12-14 14:57:53,306 - INFO - assuming fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz is an FCIDUMP file.
-2024-12-14 14:57:53,306 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz...
-2024-12-14 14:57:53,318 - INFO - Connected (version 2.0, client 0)
-2024-12-14 14:57:53,976 - INFO - Authentication (publickey) successful!
-2024-12-14 14:57:53,988 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 14:57:54,078 - INFO - [chan 0] sftp session closed.
-2024-12-14 14:57:54,488 - INFO - ===============================================
-2024-12-14 14:57:54,489 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:02:19,251 - INFO - Circuit initialization time: 264.762091 seconds.
-2024-12-14 15:02:19,251 - INFO - Estimating logical resources...
-2024-12-14 15:02:57,297 - INFO - Resource estimation time (seconds): 38.045668
-2024-12-14 15:02:57,297 - INFO - Analyzing task b9cc699a-80f8-4280-9731-23dee4d5a6a5...
-2024-12-14 15:02:57,297 - INFO - number of supporting files: 1
-2024-12-14 15:02:57,297 - INFO - supporting data file UUID: e10bd99a-435c-41cd-84f1-41bd67890fc7.
-2024-12-14 15:02:57,297 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz.
-2024-12-14 15:02:57,297 - INFO - assuming fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz is an FCIDUMP file.
-2024-12-14 15:02:57,297 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz...
-2024-12-14 15:02:57,302 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:02:57,792 - INFO - Authentication (publickey) successful!
-2024-12-14 15:02:57,806 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:02:58,095 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:03:00,126 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 15:03:00,126 - INFO - Analyzing task dfd78a05-437d-4667-88d7-7e2a3384b816...
-2024-12-14 15:03:00,126 - INFO - number of supporting files: 1
-2024-12-14 15:03:00,126 - INFO - supporting data file UUID: b71baf3c-d5f0-4f8d-aead-648ba69a058e.
-2024-12-14 15:03:00,126 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz.
-2024-12-14 15:03:00,127 - INFO - assuming fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz is an FCIDUMP file.
-2024-12-14 15:03:00,127 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz...
-2024-12-14 15:03:00,134 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:03:00,782 - INFO - Authentication (publickey) successful!
-2024-12-14 15:03:00,798 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:03:01,054 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:03:03,081 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 15:03:03,081 - INFO - Analyzing task 35c1aee4-4ef3-4e18-bc2a-377cf45e8fa1...
-2024-12-14 15:03:03,081 - INFO - number of supporting files: 1
-2024-12-14 15:03:03,081 - INFO - supporting data file UUID: 77c12db8-c32e-4f88-8552-9762a0fff763.
-2024-12-14 15:03:03,081 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz.
-2024-12-14 15:03:03,081 - INFO - assuming fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz is an FCIDUMP file.
-2024-12-14 15:03:03,081 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz...
-2024-12-14 15:03:03,086 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:03:03,717 - INFO - Authentication (publickey) successful!
-2024-12-14 15:03:03,730 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:03:03,815 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:03:04,170 - INFO - ===============================================
-2024-12-14 15:03:04,170 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:07:02,006 - INFO - Circuit initialization time: 237.835653 seconds.
-2024-12-14 15:07:02,006 - INFO - Estimating logical resources...
-2024-12-14 15:07:35,918 - INFO - Resource estimation time (seconds): 33.91144
-2024-12-14 15:07:35,920 - INFO - parsing ../problem_instances/problem_instance.li_h_0.6d355019-13aa-41fc-a530-31d5f968ba22.json
-2024-12-14 15:07:35,920 - INFO - problem_instance UUID: 6d355019-13aa-41fc-a530-31d5f968ba22
-2024-12-14 15:07:35,920 - INFO - problem_instance short name: li_h_0
-2024-12-14 15:07:35,920 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:07:35,935 - INFO - Analyzing task 92917287-d937-410c-bb70-c1f34224fab7...
-2024-12-14 15:07:35,935 - INFO - number of supporting files: 2
-2024-12-14 15:07:35,935 - INFO - supporting data file UUID: 9c6f0876-5690-4391-a98c-0347d111257e.
-2024-12-14 15:07:35,935 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz.
-2024-12-14 15:07:35,935 - INFO - assuming fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz is an FCIDUMP file.
-2024-12-14 15:07:35,935 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz...
-2024-12-14 15:07:35,941 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:07:36,603 - INFO - Authentication (publickey) successful!
-2024-12-14 15:07:36,617 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:07:36,684 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:07:36,733 - INFO - ===============================================
-2024-12-14 15:07:36,733 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 160 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 165 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 168 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:07:59,779 - INFO - Circuit initialization time: 23.045662 seconds.
-2024-12-14 15:07:59,779 - INFO - Estimating logical resources...
-2024-12-14 15:08:05,079 - INFO - Resource estimation time (seconds): 5.299925
-2024-12-14 15:08:05,079 - INFO - supporting data file UUID: 0be93350-ebd5-4fd0-bbbe-029a7cc7681b.
-2024-12-14 15:08:05,079 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVDZ.0be93350-ebd5-4fd0-bbbe-029a7cc7681b.chk.
-2024-12-14 15:08:05,080 - INFO - assuming li_h_cc-pVDZ.0be93350-ebd5-4fd0-bbbe-029a7cc7681b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:08:05,080 - INFO - Analyzing task 13b4bdcc-1cef-419a-92b1-156febff71d4...
-2024-12-14 15:08:05,080 - INFO - number of supporting files: 2
-2024-12-14 15:08:05,080 - INFO - supporting data file UUID: c21d87dd-9338-4498-8ed6-95b0dacd75b1.
-2024-12-14 15:08:05,080 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz.
-2024-12-14 15:08:05,080 - INFO - assuming fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz is an FCIDUMP file.
-2024-12-14 15:08:05,080 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz...
-2024-12-14 15:08:05,084 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:08:05,755 - INFO - Authentication (publickey) successful!
-2024-12-14 15:08:05,772 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:08:17,028 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:08:29,685 - INFO - Skipping Logical Resource Estimate because number of orbitals (85) exceeds maximum specified in config (32).
-2024-12-14 15:08:29,685 - INFO - supporting data file UUID: 10693a03-698b-416a-80c0-dd563193c1d4.
-2024-12-14 15:08:29,685 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVQZ.10693a03-698b-416a-80c0-dd563193c1d4.chk.
-2024-12-14 15:08:29,685 - INFO - assuming li_h_cc-pVQZ.10693a03-698b-416a-80c0-dd563193c1d4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:08:29,685 - INFO - Analyzing task d15db194-aa2d-4de9-8f86-fcffeb82f38b...
-2024-12-14 15:08:29,686 - INFO - number of supporting files: 2
-2024-12-14 15:08:29,686 - INFO - supporting data file UUID: 02d12f52-ff42-4adf-99b9-acada93cb96b.
-2024-12-14 15:08:29,686 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz.
-2024-12-14 15:08:29,686 - INFO - assuming fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz is an FCIDUMP file.
-2024-12-14 15:08:29,686 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz...
-2024-12-14 15:08:29,692 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:08:30,343 - INFO - Authentication (publickey) successful!
-2024-12-14 15:08:30,357 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:08:30,524 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:08:31,880 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 15:08:31,880 - INFO - supporting data file UUID: 17337d1b-d2a5-4121-bf4a-d7236edd5c05.
-2024-12-14 15:08:31,880 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li_h_cc-pVTZ.17337d1b-d2a5-4121-bf4a-d7236edd5c05.chk.
-2024-12-14 15:08:31,880 - INFO - assuming li_h_cc-pVTZ.17337d1b-d2a5-4121-bf4a-d7236edd5c05.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:08:31,882 - INFO - parsing ../problem_instances/problem_instance.li2_0.3301a356-21a9-472b-8021-f02f4d2c9eec.json
-2024-12-14 15:08:31,883 - INFO - problem_instance UUID: 3301a356-21a9-472b-8021-f02f4d2c9eec
-2024-12-14 15:08:31,883 - INFO - problem_instance short name: li2_0
-2024-12-14 15:08:31,883 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:08:31,898 - INFO - Analyzing task e7d3b8bd-ff6c-44f6-8a9e-b9b75396cee0...
-2024-12-14 15:08:31,898 - INFO - number of supporting files: 2
-2024-12-14 15:08:31,898 - INFO - supporting data file UUID: 243670ee-2d2e-4d90-abc1-16938a04a80b.
-2024-12-14 15:08:31,898 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz.
-2024-12-14 15:08:31,898 - INFO - assuming fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz is an FCIDUMP file.
-2024-12-14 15:08:31,898 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz...
-2024-12-14 15:08:31,903 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:08:32,564 - INFO - Authentication (publickey) successful!
-2024-12-14 15:08:32,579 - INFO - [chan 0] Opened sftp connection (server version 3)
-Downloading gsee/fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz to fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b.gz...
-Parsing fcidump.62_3_15_af_noncan_0.2_new.6e2bf415-6a69-4b36-ba0f-780a11cb7c0b
-Downloading gsee/fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz to fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821.gz...
-Parsing fcidump.63_5_15_af_ts_noncan_0.2_new.027490ba-34f9-4340-89ab-27fd110d2821
-Downloading gsee/fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz to fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8.gz...
-Parsing fcidump.64_5_15_af_ts_noncan_0.2_new.bae2da57-6a69-483e-95bc-b77f72ebfba8
-Downloading gsee/fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz to fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573.gz...
-Parsing fcidump.65_5_15_af_noncan_0.2_new.72343006-774e-4192-b481-fa840ed25573
-Downloading gsee/fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz to fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5.gz...
-Parsing fcidump.66_5_15_af_noncan_0.2_new.ea55abec-8253-445d-85fa-914948b5e5a5
-Downloading gsee/small_molecules/fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz to fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459.gz...
-Parsing fcidump.FeO_vdz.3f1777dc-c493-4aa7-b3d1-6271d9bed459
-Downloading gsee/small_molecules/fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz to fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1.gz...
-Parsing fcidump.p_h3_cc-pVDZ.7ffaab25-7912-4ca9-b0e5-9fe8fd00a0e1
-Downloading gsee/small_molecules/fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz to fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761.gz...
-Parsing fcidump.p_h3_cc-pVTZ.2b73f8d0-08fe-4cca-9e8a-cda5d21f4761
-Downloading gsee/small_molecules/fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz to fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9.gz...
-Parsing fcidump.h2_s_cc-pVDZ.11a0ff0b-3c6f-416f-be8a-a02acd56aeb9
-Downloading gsee/small_molecules/fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz to fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f.gz...
-Parsing fcidump.h2_s_cc-pVQZ.57afbbf8-5819-4ee7-b540-95974b8a1a3f
-Downloading gsee/small_molecules/fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz to fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f.gz...
-Parsing fcidump.h2_s_cc-pVTZ.83f0f242-e184-4581-a77a-f019731d8a6f
-Downloading gsee/small_molecules/fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz to fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154.gz...
-Parsing fcidump.Sc0_vdz.9da0b1fb-c6a5-4da5-b390-3920e3c26154
-Downloading gsee/small_molecules/fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz to fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2.gz...
-Parsing fcidump.Sc0_vqz.85c6b46a-59fe-4506-89d3-e6faec2383e2
-Downloading gsee/small_molecules/fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz to fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080.gz...
-Parsing fcidump.Sc0_vtz.83008296-5ec9-4af7-a03b-372025fad080
-Downloading gsee/small_molecules/fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz to fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72.gz...
-Parsing fcidump.na_cl_cc-pVDZ.cd31956d-bef5-4112-9959-510170644e72
-Downloading gsee/small_molecules/fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz to fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7.gz...
-Parsing fcidump.na_cl_cc-pVQZ.677d97ee-5a46-4d49-82d6-ca3fc98a59a7
-Downloading gsee/small_molecules/fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz to fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d.gz...
-Parsing fcidump.na_cl_cc-pVTZ.444f3f27-904b-463f-b2f2-c92686c9637d
-Downloading gsee/small_molecules/fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz to fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f.gz...
-Parsing fcidump.c2_h2_cc-pVDZ.5b507b3d-b6fc-4e13-9586-06113819d99f
-Downloading gsee/small_molecules/fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz to fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87.gz...
-Parsing fcidump.c2_h2_cc-pVTZ.57793481-c847-4746-8241-ea949add5f87
-Downloading gsee/small_molecules/fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz to fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63.gz...
-Parsing fcidump.li_f_cc-pVDZ.19cf5a4d-e90f-4ab1-a062-b20089724a63
-Downloading gsee/small_molecules/fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz to fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c.gz...
-Parsing fcidump.li_f_cc-pVQZ.2294b211-7a05-445e-810d-4c1706e1444c
-Downloading gsee/small_molecules/fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz to fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c.gz...
-Parsing fcidump.li_f_cc-pVTZ.c0df5db1-1bc0-40f5-9cff-6aa2867aba7c
-Downloading gsee/small_molecules/fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz to fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1.gz...
-Parsing fcidump.h2_c_o_cc-pVDZ.d3d8851e-f3df-490c-975a-467933bd9fa1
-Downloading gsee/small_molecules/fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz to fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47.gz...
-Parsing fcidump.h2_c_o_cc-pVTZ.f1c78add-0e23-423a-bb96-f1370626aa47
-Downloading gsee/planted_solutions/fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz to fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8.gz...
-Parsing fcidump.planted_solution_0011.befcf6f0-cfcb-49b7-b661-de48ad8a44c8
-Downloading gsee/small_molecules/fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz to fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d.gz...
-Parsing fcidump.Mn0_vdz.a83413fb-96e3-466e-910b-6d4bab7cdf1d
-Downloading gsee/small_molecules/fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz to fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c.gz...
-Parsing fcidump.Mn0_vtz.07c9da30-e172-4183-a8af-301628b75f1c
-Downloading gsee/planted_solutions/fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz to fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716.gz...
-Parsing fcidump.planted_solution_0008.44060124-8f2d-4a91-80a9-5a29f0f4f716
-Downloading gsee/fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz to fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e.gz...
-Parsing fcidump.9_mo_n2-_noncan_0.2_new.23aa47ca-9afe-4086-bd97-75de310e033e
-Downloading gsee/fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz to fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7.gz...
-Parsing fcidump.10_fecp2+_s0.5_noncan_0.2_new.e10bd99a-435c-41cd-84f1-41bd67890fc7
-Downloading gsee/fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz to fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e.gz...
-Parsing fcidump.11_fecp2_s0_noncan_0.2_new.b71baf3c-d5f0-4f8d-aead-648ba69a058e
-Downloading gsee/fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz to fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763.gz...
-Parsing fcidump.12_mo_n2_noncan_0.2_new.77c12db8-c32e-4f88-8552-9762a0fff763
-Downloading gsee/small_molecules/fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz to fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e.gz...
-Parsing fcidump.li_h_cc-pVDZ.9c6f0876-5690-4391-a98c-0347d111257e
-Downloading gsee/small_molecules/fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz to fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1.gz...
-Parsing fcidump.li_h_cc-pVQZ.c21d87dd-9338-4498-8ed6-95b0dacd75b1
-Downloading gsee/small_molecules/fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz to fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b.gz...
-Parsing fcidump.li_h_cc-pVTZ.02d12f52-ff42-4adf-99b9-acada93cb96b
-2024-12-14 15:08:32,648 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:08:32,797 - INFO - ===============================================
-2024-12-14 15:08:32,797 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 322 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 323 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 324 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 325 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 327 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 328 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 329 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 330 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 331 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 332 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 333 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 334 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 335 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 336 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 337 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 338 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 339 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 340 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 341 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 342 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 343 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 344 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 345 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 346 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 347 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 348 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 349 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 350 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 15:09:58,807 - INFO - Circuit initialization time: 86.009777 seconds.
-2024-12-14 15:09:58,807 - INFO - Estimating logical resources...
-2024-12-14 15:10:15,339 - INFO - Resource estimation time (seconds): 16.531839
-2024-12-14 15:10:15,340 - INFO - supporting data file UUID: 948cb44e-e229-4be7-ba48-8ee73e042a6a.
-2024-12-14 15:10:15,340 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVDZ.948cb44e-e229-4be7-ba48-8ee73e042a6a.chk.
-2024-12-14 15:10:15,340 - INFO - assuming li2_cc-pVDZ.948cb44e-e229-4be7-ba48-8ee73e042a6a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:10:15,340 - INFO - Analyzing task aaa24a30-ade6-44a6-b6aa-51bf54c31eef...
-2024-12-14 15:10:15,340 - INFO - number of supporting files: 2
-2024-12-14 15:10:15,340 - INFO - supporting data file UUID: 6224abe8-831e-4b52-b8d9-8ebac0a35c2b.
-2024-12-14 15:10:15,340 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz.
-2024-12-14 15:10:15,340 - INFO - assuming fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz is an FCIDUMP file.
-2024-12-14 15:10:15,340 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz...
-2024-12-14 15:10:15,345 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:10:15,994 - INFO - Authentication (publickey) successful!
-2024-12-14 15:10:16,009 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:10:43,086 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:11:07,696 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 15:11:07,696 - INFO - supporting data file UUID: 2c2461b8-9343-4405-a3d5-aadd0a6cdac9.
-2024-12-14 15:11:07,696 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVQZ.2c2461b8-9343-4405-a3d5-aadd0a6cdac9.chk.
-2024-12-14 15:11:07,696 - INFO - assuming li2_cc-pVQZ.2c2461b8-9343-4405-a3d5-aadd0a6cdac9.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:11:07,696 - INFO - Analyzing task 410cd417-988a-4f7f-99ad-93dda7eacdcb...
-2024-12-14 15:11:07,696 - INFO - number of supporting files: 2
-2024-12-14 15:11:07,696 - INFO - supporting data file UUID: 26d2547c-96a4-400d-9528-9987ae6699b2.
-2024-12-14 15:11:07,696 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz.
-2024-12-14 15:11:07,696 - INFO - assuming fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz is an FCIDUMP file.
-2024-12-14 15:11:07,696 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz...
-2024-12-14 15:11:07,701 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:11:08,361 - INFO - Authentication (publickey) successful!
-2024-12-14 15:11:08,376 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:11:08,694 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:11:11,500 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 15:11:11,500 - INFO - supporting data file UUID: e51ca409-0d43-4958-b89d-b0a3906c91d5.
-2024-12-14 15:11:11,500 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/li2_cc-pVTZ.e51ca409-0d43-4958-b89d-b0a3906c91d5.chk.
-2024-12-14 15:11:11,500 - INFO - assuming li2_cc-pVTZ.e51ca409-0d43-4958-b89d-b0a3906c91d5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:11:11,502 - INFO - parsing ../problem_instances/problem_instance.h_f_0.892e3341-7186-44c6-9a1a-20f270ddc8b8.json
-2024-12-14 15:11:11,502 - INFO - problem_instance UUID: 892e3341-7186-44c6-9a1a-20f270ddc8b8
-2024-12-14 15:11:11,502 - INFO - problem_instance short name: h_f_0
-2024-12-14 15:11:11,502 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:11:11,517 - INFO - Analyzing task b59bd259-4941-4cec-bca5-e2795c35d8e0...
-2024-12-14 15:11:11,517 - INFO - number of supporting files: 2
-2024-12-14 15:11:11,518 - INFO - supporting data file UUID: b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.
-2024-12-14 15:11:11,518 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz.
-2024-12-14 15:11:11,518 - INFO - assuming fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz is an FCIDUMP file.
-2024-12-14 15:11:11,518 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz...
-2024-12-14 15:11:11,525 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:11:12,187 - INFO - Authentication (publickey) successful!
-2024-12-14 15:11:12,203 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:11:12,261 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:11:12,312 - INFO - ===============================================
-2024-12-14 15:11:12,312 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 154 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 163 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 166 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 167 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 168 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 169 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 170 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 171 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:11:35,473 - INFO - Circuit initialization time: 23.161137 seconds.
-2024-12-14 15:11:35,473 - INFO - Estimating logical resources...
-2024-12-14 15:11:40,715 - INFO - Resource estimation time (seconds): 5.241502
-2024-12-14 15:11:40,715 - INFO - supporting data file UUID: 3bb657ac-2131-4ee7-9859-9e4ff876245a.
-2024-12-14 15:11:40,715 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVDZ.3bb657ac-2131-4ee7-9859-9e4ff876245a.chk.
-2024-12-14 15:11:40,715 - INFO - assuming h_f_cc-pVDZ.3bb657ac-2131-4ee7-9859-9e4ff876245a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:11:40,715 - INFO - Analyzing task 9e3c577f-a25d-42f5-a809-61dfb63a52de...
-2024-12-14 15:11:40,715 - INFO - number of supporting files: 2
-2024-12-14 15:11:40,715 - INFO - supporting data file UUID: ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.
-2024-12-14 15:11:40,715 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz.
-2024-12-14 15:11:40,715 - INFO - assuming fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz is an FCIDUMP file.
-2024-12-14 15:11:40,715 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz...
-2024-12-14 15:11:40,721 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:11:41,383 - INFO - Authentication (publickey) successful!
-2024-12-14 15:11:41,401 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:11:52,353 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:12:11,014 - INFO - Skipping Logical Resource Estimate because number of orbitals (85) exceeds maximum specified in config (32).
-2024-12-14 15:12:11,014 - INFO - supporting data file UUID: ddc246a3-9770-4542-8cfd-74afbff4e7a0.
-2024-12-14 15:12:11,014 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVQZ.ddc246a3-9770-4542-8cfd-74afbff4e7a0.chk.
-2024-12-14 15:12:11,014 - INFO - assuming h_f_cc-pVQZ.ddc246a3-9770-4542-8cfd-74afbff4e7a0.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:12:11,014 - INFO - Analyzing task daa86ad6-bda9-4d47-a50d-4ec34801bd82...
-2024-12-14 15:12:11,014 - INFO - number of supporting files: 2
-2024-12-14 15:12:11,014 - INFO - supporting data file UUID: 819ffa8e-51ee-4e78-aa07-17686d7a9488.
-2024-12-14 15:12:11,015 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz.
-2024-12-14 15:12:11,015 - INFO - assuming fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz is an FCIDUMP file.
-2024-12-14 15:12:11,015 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz...
-2024-12-14 15:12:11,020 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:12:11,661 - INFO - Authentication (publickey) successful!
-2024-12-14 15:12:11,678 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:12:11,850 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:12:13,384 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 15:12:13,384 - INFO - supporting data file UUID: 7369a736-b751-4ace-a057-7f6a07194ffa.
-2024-12-14 15:12:13,384 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_f_cc-pVTZ.7369a736-b751-4ace-a057-7f6a07194ffa.chk.
-2024-12-14 15:12:13,384 - INFO - assuming h_f_cc-pVTZ.7369a736-b751-4ace-a057-7f6a07194ffa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:12:13,386 - INFO - parsing ../problem_instances/problem_instance.Fe_0.05abb33d-ecea-406f-8832-31a814b26dfd.json
-2024-12-14 15:12:13,387 - INFO - problem_instance UUID: 05abb33d-ecea-406f-8832-31a814b26dfd
-2024-12-14 15:12:13,387 - INFO - problem_instance short name: Fe_0
-2024-12-14 15:12:13,387 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:12:13,402 - INFO - Analyzing task 5b8f4746-a08b-4ec5-92e2-ce55cc2fdb75...
-2024-12-14 15:12:13,402 - INFO - number of supporting files: 2
-2024-12-14 15:12:13,403 - INFO - supporting data file UUID: 133ec573-3d06-4582-b2f5-8afe8be8dbe3.
-2024-12-14 15:12:13,403 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz.
-2024-12-14 15:12:13,403 - INFO - assuming fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz is an FCIDUMP file.
-2024-12-14 15:12:13,403 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz...
-2024-12-14 15:12:13,407 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:12:14,077 - INFO - Authentication (publickey) successful!
-2024-12-14 15:12:14,093 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:12:16,236 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:12:23,627 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:12:23,627 - INFO - supporting data file UUID: 6644ed13-743e-4f98-8ab9-6c2abf88d032.
-2024-12-14 15:12:23,627 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe0_vdz.6644ed13-743e-4f98-8ab9-6c2abf88d032.chk.
-2024-12-14 15:12:23,627 - INFO - assuming Fe0_vdz.6644ed13-743e-4f98-8ab9-6c2abf88d032.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:12:23,627 - INFO - Analyzing task c63f5f9b-ee73-4887-949b-dd1e74c31874...
-2024-12-14 15:12:23,627 - INFO - number of supporting files: 2
-2024-12-14 15:12:23,627 - INFO - supporting data file UUID: cb274492-6acb-4426-a4f6-8cb4a8cef3c5.
-2024-12-14 15:12:23,627 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz.
-2024-12-14 15:12:23,627 - INFO - assuming fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz is an FCIDUMP file.
-2024-12-14 15:12:23,627 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz...
-2024-12-14 15:12:23,632 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:12:24,283 - INFO - Authentication (publickey) successful!
-2024-12-14 15:12:24,298 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:13:55,469 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:14:46,130 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 15:14:46,130 - INFO - supporting data file UUID: 9d520d39-2e21-4294-8d58-af6d068b38de.
-2024-12-14 15:14:46,130 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe0_vtz.9d520d39-2e21-4294-8d58-af6d068b38de.chk.
-2024-12-14 15:14:46,130 - INFO - assuming Fe0_vtz.9d520d39-2e21-4294-8d58-af6d068b38de.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:14:46,135 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0010.bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8.json
-2024-12-14 15:14:46,135 - INFO - problem_instance UUID: bf3fb654-72c7-4fd4-bfd1-9ffef5aaebd8
-2024-12-14 15:14:46,135 - INFO - problem_instance short name: planted_solution_0010
-2024-12-14 15:14:46,135 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:14:46,151 - INFO - Analyzing task 7cc1ed5c-0dcb-4315-9e51-2ae94b5cdd02...
-2024-12-14 15:14:46,151 - INFO - number of supporting files: 1
-2024-12-14 15:14:46,151 - INFO - supporting data file UUID: eea867d0-285e-462d-94ab-15579c782be7.
-2024-12-14 15:14:46,151 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz.
-2024-12-14 15:14:46,151 - INFO - assuming fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz is an FCIDUMP file.
-2024-12-14 15:14:46,151 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz...
-2024-12-14 15:14:46,156 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:14:46,769 - INFO - Authentication (publickey) successful!
-2024-12-14 15:14:46,784 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:14:46,861 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:14:47,187 - INFO - ===============================================
-2024-12-14 15:14:47,187 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 91 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 93 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 94 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 95 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 96 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 97 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 98 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 99 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 100 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:17:35,624 - INFO - Circuit initialization time: 168.436994 seconds.
-2024-12-14 15:17:35,625 - INFO - Estimating logical resources...
-2024-12-14 15:17:41,872 - INFO - Resource estimation time (seconds): 6.246897
-2024-12-14 15:17:41,874 - INFO - parsing ../problem_instances/problem_instance.ru_macho.b78a10f2-ce8a-43c0-69ec-4cf666d8e85c.json
-2024-12-14 15:17:41,875 - INFO - problem_instance UUID: b78a10f2-ce8a-43c0-69ec-4cf666d8e85c
-2024-12-14 15:17:41,875 - INFO - problem_instance short name: ru_macho
-2024-12-14 15:17:41,875 - INFO - contains 9 associated Hamiltonians.
-2024-12-14 15:17:41,891 - INFO - Analyzing task 4357d5bb-ed2b-466a-947b-e868afb81d3d...
-2024-12-14 15:17:41,891 - INFO - number of supporting files: 1
-2024-12-14 15:17:41,891 - INFO - supporting data file UUID: 1dc29784-ab7f-45a1-9821-31fea4363d74.
-2024-12-14 15:17:41,891 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz.
-2024-12-14 15:17:41,891 - INFO - assuming fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz is an FCIDUMP file.
-2024-12-14 15:17:41,891 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz...
-2024-12-14 15:17:41,896 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:17:42,400 - INFO - Authentication (publickey) successful!
-2024-12-14 15:17:42,416 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:17:42,473 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:17:42,474 - INFO - ===============================================
-2024-12-14 15:17:42,474 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:17:44,127 - INFO - Circuit initialization time: 1.65235 seconds.
-2024-12-14 15:17:44,127 - INFO - Estimating logical resources...
-2024-12-14 15:17:44,660 - INFO - Resource estimation time (seconds): 0.533004
-2024-12-14 15:17:44,660 - INFO - Analyzing task b164af91-a758-445c-8e78-610ffd2ad795...
-2024-12-14 15:17:44,660 - INFO - number of supporting files: 1
-2024-12-14 15:17:44,660 - INFO - supporting data file UUID: 5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.
-2024-12-14 15:17:44,661 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz.
-2024-12-14 15:17:44,661 - INFO - assuming fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz is an FCIDUMP file.
-2024-12-14 15:17:44,661 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz...
-2024-12-14 15:17:44,666 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:17:45,339 - INFO - Authentication (publickey) successful!
-2024-12-14 15:17:45,354 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:17:45,405 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:17:45,410 - INFO - ===============================================
-2024-12-14 15:17:45,410 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:17:48,653 - INFO - Circuit initialization time: 3.242435 seconds.
-2024-12-14 15:17:48,653 - INFO - Estimating logical resources...
-2024-12-14 15:17:49,857 - INFO - Resource estimation time (seconds): 1.204043
-2024-12-14 15:17:49,857 - INFO - Analyzing task 28bd4997-c04c-4914-9984-0101713041fe...
-2024-12-14 15:17:49,857 - INFO - number of supporting files: 1
-2024-12-14 15:17:49,857 - INFO - supporting data file UUID: 587f69a8-4295-4d6d-811e-0eacfbc5f6dd.
-2024-12-14 15:17:49,857 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz.
-2024-12-14 15:17:49,857 - INFO - assuming fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz is an FCIDUMP file.
-2024-12-14 15:17:49,858 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz...
-2024-12-14 15:17:49,862 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:17:50,543 - INFO - Authentication (publickey) successful!
-2024-12-14 15:17:50,558 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:17:50,619 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:17:50,637 - INFO - ===============================================
-2024-12-14 15:17:50,638 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:18:02,239 - INFO - Circuit initialization time: 11.601499 seconds.
-2024-12-14 15:18:02,240 - INFO - Estimating logical resources...
-2024-12-14 15:18:05,423 - INFO - Resource estimation time (seconds): 3.18328
-2024-12-14 15:18:05,423 - INFO - Analyzing task dcf2b441-b297-4a89-ae18-5778ec2d674d...
-2024-12-14 15:18:05,423 - INFO - number of supporting files: 1
-2024-12-14 15:18:05,423 - INFO - supporting data file UUID: 46aea10c-d57f-4133-9837-3c57d474d9a2.
-2024-12-14 15:18:05,423 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz.
-2024-12-14 15:18:05,423 - INFO - assuming fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz is an FCIDUMP file.
-2024-12-14 15:18:05,424 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz...
-2024-12-14 15:18:05,428 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:18:06,081 - INFO - Authentication (publickey) successful!
-2024-12-14 15:18:06,096 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:18:06,154 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:18:06,165 - INFO - ===============================================
-2024-12-14 15:18:06,166 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:18:13,270 - INFO - Circuit initialization time: 7.104375 seconds.
-2024-12-14 15:18:13,270 - INFO - Estimating logical resources...
-2024-12-14 15:18:15,337 - INFO - Resource estimation time (seconds): 2.06686
-2024-12-14 15:18:15,337 - INFO - Analyzing task 6346b7fe-a4a5-4b10-a79b-706d4339923e...
-2024-12-14 15:18:15,337 - INFO - number of supporting files: 1
-2024-12-14 15:18:15,337 - INFO - supporting data file UUID: 496aaf89-2cdf-43cf-8b25-246e915cc8b5.
-2024-12-14 15:18:15,337 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz.
-2024-12-14 15:18:15,338 - INFO - assuming fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz is an FCIDUMP file.
-2024-12-14 15:18:15,338 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz...
-2024-12-14 15:18:15,342 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:18:15,990 - INFO - Authentication (publickey) successful!
-2024-12-14 15:18:16,008 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:18:16,104 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:18:16,636 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 15:18:16,636 - INFO - Analyzing task 68db6781-dd54-43c4-b667-7b754c4d5cdb...
-2024-12-14 15:18:16,637 - INFO - number of supporting files: 1
-2024-12-14 15:18:16,637 - INFO - supporting data file UUID: 0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.
-2024-12-14 15:18:16,637 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz.
-2024-12-14 15:18:16,637 - INFO - assuming fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz is an FCIDUMP file.
-2024-12-14 15:18:16,637 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz...
-2024-12-14 15:18:16,642 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:18:17,311 - INFO - Authentication (publickey) successful!
-2024-12-14 15:18:17,326 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:18:17,404 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:18:17,536 - INFO - ===============================================
-2024-12-14 15:18:17,536 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:19:36,349 - INFO - Circuit initialization time: 78.812818 seconds.
-2024-12-14 15:19:36,349 - INFO - Estimating logical resources...
-2024-12-14 15:19:49,982 - INFO - Resource estimation time (seconds): 13.632504
-2024-12-14 15:19:49,982 - INFO - Analyzing task d3ecd428-ee03-4d8b-aa14-af4d935781ed...
-2024-12-14 15:19:49,982 - INFO - number of supporting files: 1
-2024-12-14 15:19:49,982 - INFO - supporting data file UUID: e5e63f77-dbaa-431c-a53f-93c0f4c0758d.
-2024-12-14 15:19:49,982 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz.
-2024-12-14 15:19:49,982 - INFO - assuming fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz is an FCIDUMP file.
-2024-12-14 15:19:49,982 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz...
-2024-12-14 15:19:49,987 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:19:50,647 - INFO - Authentication (publickey) successful!
-2024-12-14 15:19:50,663 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:19:51,052 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:19:52,844 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 15:19:52,845 - INFO - Analyzing task 89253c8f-0f01-4046-a138-1bada22f0a6a...
-2024-12-14 15:19:52,845 - INFO - number of supporting files: 1
-2024-12-14 15:19:52,845 - INFO - supporting data file UUID: d7bea809-6e34-49f8-8daf-8d728dd18268.
-2024-12-14 15:19:52,845 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz.
-2024-12-14 15:19:52,845 - INFO - assuming fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz is an FCIDUMP file.
-2024-12-14 15:19:52,845 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz...
-2024-12-14 15:19:52,850 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:19:53,505 - INFO - Authentication (publickey) successful!
-2024-12-14 15:19:53,521 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:19:53,574 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:19:53,664 - INFO - ===============================================
-2024-12-14 15:19:53,664 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:20:44,796 - INFO - Circuit initialization time: 51.132174 seconds.
-2024-12-14 15:20:44,796 - INFO - Estimating logical resources...
-2024-12-14 15:20:55,114 - INFO - Resource estimation time (seconds): 10.317261
-2024-12-14 15:20:55,114 - INFO - Analyzing task 842d2152-2f91-4dce-b088-7ed26afb2381...
-2024-12-14 15:20:55,114 - INFO - number of supporting files: 1
-2024-12-14 15:20:55,114 - INFO - supporting data file UUID: 73ae455f-a729-4fac-a626-5654b03c1ef5.
-2024-12-14 15:20:55,114 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz.
-2024-12-14 15:20:55,114 - INFO - assuming fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz is an FCIDUMP file.
-2024-12-14 15:20:55,114 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz...
-2024-12-14 15:20:55,119 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:20:55,783 - INFO - Authentication (publickey) successful!
-2024-12-14 15:20:55,799 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:20:55,949 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:20:57,295 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 15:20:57,297 - INFO - parsing ../problem_instances/problem_instance.Cu_1.d5c7ab73-dfc1-499e-9027-601476004107.json
-2024-12-14 15:20:57,298 - INFO - problem_instance UUID: d5c7ab73-dfc1-499e-9027-601476004107
-2024-12-14 15:20:57,298 - INFO - problem_instance short name: Cu_1
-2024-12-14 15:20:57,298 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:20:57,313 - INFO - Analyzing task 5f5fee92-5821-4d38-a54a-d204660f205f...
-2024-12-14 15:20:57,313 - INFO - number of supporting files: 2
-2024-12-14 15:20:57,313 - INFO - supporting data file UUID: 6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.
-2024-12-14 15:20:57,313 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz.
-2024-12-14 15:20:57,313 - INFO - assuming fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz is an FCIDUMP file.
-2024-12-14 15:20:57,313 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz...
-2024-12-14 15:20:57,319 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:20:57,816 - INFO - Authentication (publickey) successful!
-2024-12-14 15:20:57,830 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:20:58,393 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:21:02,089 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:21:02,089 - INFO - supporting data file UUID: 36737c9f-2f69-4963-91a1-daf7a2a3fcfd.
-2024-12-14 15:21:02,089 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu1_vdz.36737c9f-2f69-4963-91a1-daf7a2a3fcfd.chk.
-2024-12-14 15:21:02,090 - INFO - assuming Cu1_vdz.36737c9f-2f69-4963-91a1-daf7a2a3fcfd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:21:02,090 - INFO - Analyzing task 1c7f5399-8982-4daf-81a5-7cef4e4588cc...
-2024-12-14 15:21:02,090 - INFO - number of supporting files: 2
-2024-12-14 15:21:02,090 - INFO - supporting data file UUID: 68952c71-d281-40fa-bcd2-cb0352f70a89.
-2024-12-14 15:21:02,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz.
-2024-12-14 15:21:02,090 - INFO - assuming fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz is an FCIDUMP file.
-2024-12-14 15:21:02,090 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz...
-2024-12-14 15:21:02,095 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:21:02,753 - INFO - Authentication (publickey) successful!
-2024-12-14 15:21:02,768 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:21:24,960 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:21:50,009 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 15:21:50,010 - INFO - supporting data file UUID: d9bbc858-2cef-43ee-896f-c9059d2b13b5.
-2024-12-14 15:21:50,010 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cu1_vtz.d9bbc858-2cef-43ee-896f-c9059d2b13b5.chk.
-2024-12-14 15:21:50,010 - INFO - assuming Cu1_vtz.d9bbc858-2cef-43ee-896f-c9059d2b13b5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:21:50,011 - INFO - parsing ../problem_instances/problem_instance.n_h3_0.127cfea5-8a7d-45a0-9012-949816a0b8d9.json
-2024-12-14 15:21:50,012 - INFO - problem_instance UUID: 127cfea5-8a7d-45a0-9012-949816a0b8d9
-2024-12-14 15:21:50,012 - INFO - problem_instance short name: n_h3_0
-2024-12-14 15:21:50,012 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:21:50,027 - INFO - Analyzing task 77c3a92c-066c-4043-a4a1-5e8324014d0b...
-2024-12-14 15:21:50,027 - INFO - number of supporting files: 2
-2024-12-14 15:21:50,028 - INFO - supporting data file UUID: 9820e181-088a-4b00-8a14-8cafb952ccdd.
-2024-12-14 15:21:50,028 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz.
-2024-12-14 15:21:50,028 - INFO - assuming fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz is an FCIDUMP file.
-2024-12-14 15:21:50,028 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz...
-2024-12-14 15:21:50,038 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:21:50,676 - INFO - Authentication (publickey) successful!
-2024-12-14 15:21:50,690 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:21:50,770 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:21:51,134 - INFO - ===============================================
-2024-12-14 15:21:51,134 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 367 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 368 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 369 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 371 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 372 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 373 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:24:41,982 - INFO - Circuit initialization time: 170.848081 seconds.
-2024-12-14 15:24:41,982 - INFO - Estimating logical resources...
-2024-12-14 15:25:08,949 - INFO - Resource estimation time (seconds): 26.96626
-2024-12-14 15:25:08,949 - INFO - supporting data file UUID: e3cda046-ae0d-47d9-b012-7f1e5f632f71.
-2024-12-14 15:25:08,949 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n_h3_cc-pVDZ.e3cda046-ae0d-47d9-b012-7f1e5f632f71.chk.
-2024-12-14 15:25:08,949 - INFO - assuming n_h3_cc-pVDZ.e3cda046-ae0d-47d9-b012-7f1e5f632f71.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:25:08,949 - INFO - Analyzing task 1094e868-f84e-403b-9b54-50802b1cdb60...
-2024-12-14 15:25:08,949 - INFO - number of supporting files: 2
-2024-12-14 15:25:08,949 - INFO - supporting data file UUID: 3b423f54-aa64-4331-a59b-d6c37de1fbb6.
-2024-12-14 15:25:08,949 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz.
-2024-12-14 15:25:08,949 - INFO - assuming fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz is an FCIDUMP file.
-2024-12-14 15:25:08,949 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz...
-2024-12-14 15:25:08,954 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:25:09,626 - INFO - Authentication (publickey) successful!
-2024-12-14 15:25:09,646 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:25:41,888 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:25:56,632 - INFO - Skipping Logical Resource Estimate because number of orbitals (72) exceeds maximum specified in config (32).
-2024-12-14 15:25:56,633 - INFO - supporting data file UUID: 15125674-abf8-4db2-9db6-9d293b677584.
-2024-12-14 15:25:56,633 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n_h3_cc-pVTZ.15125674-abf8-4db2-9db6-9d293b677584.chk.
-2024-12-14 15:25:56,633 - INFO - assuming n_h3_cc-pVTZ.15125674-abf8-4db2-9db6-9d293b677584.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:25:56,635 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0006.42958a3e-8b35-4992-acd8-6711848066c1.json
-2024-12-14 15:25:56,635 - INFO - problem_instance UUID: 42958a3e-8b35-4992-acd8-6711848066c1
-2024-12-14 15:25:56,635 - INFO - problem_instance short name: planted_solution_0006
-2024-12-14 15:25:56,635 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:25:56,651 - INFO - Analyzing task d28f02ba-d43f-4df9-a01a-f1e8ac326e08...
-2024-12-14 15:25:56,651 - INFO - number of supporting files: 1
-2024-12-14 15:25:56,651 - INFO - supporting data file UUID: a4b9a6bd-4479-44b2-b172-642f74396781.
-2024-12-14 15:25:56,651 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz.
-2024-12-14 15:25:56,651 - INFO - assuming fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz is an FCIDUMP file.
-2024-12-14 15:25:56,651 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz...
-2024-12-14 15:25:56,657 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:25:57,154 - INFO - Authentication (publickey) successful!
-2024-12-14 15:25:57,202 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:25:57,268 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:25:57,288 - INFO - ===============================================
-2024-12-14 15:25:57,288 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:26:06,758 - INFO - Circuit initialization time: 9.469449 seconds.
-2024-12-14 15:26:06,758 - INFO - Estimating logical resources...
-2024-12-14 15:26:08,290 - INFO - Resource estimation time (seconds): 1.53208
-2024-12-14 15:26:08,292 - INFO - parsing ../problem_instances/problem_instance.n2_h4_0.f1a6b508-75e8-4afb-9c81-fc61af11b523.json
-2024-12-14 15:26:08,293 - INFO - problem_instance UUID: f1a6b508-75e8-4afb-9c81-fc61af11b523
-2024-12-14 15:26:08,293 - INFO - problem_instance short name: n2_h4_0
-2024-12-14 15:26:08,293 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:26:08,307 - INFO - Analyzing task 828c931b-4d5a-486e-ba26-abb293c1ccef...
-2024-12-14 15:26:08,308 - INFO - number of supporting files: 2
-2024-12-14 15:26:08,308 - INFO - supporting data file UUID: aba33661-3ce8-4f28-824f-e98244906d94.
-2024-12-14 15:26:08,308 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz.
-2024-12-14 15:26:08,308 - INFO - assuming fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz is an FCIDUMP file.
-2024-12-14 15:26:08,308 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz...
-2024-12-14 15:26:08,314 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:26:08,951 - INFO - Authentication (publickey) successful!
-2024-12-14 15:26:08,966 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:26:10,922 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:26:15,596 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 15:26:15,596 - INFO - supporting data file UUID: 93193d14-3f99-4495-bcf8-e60f9d863904.
-2024-12-14 15:26:15,596 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_h4_cc-pVDZ.93193d14-3f99-4495-bcf8-e60f9d863904.chk.
-2024-12-14 15:26:15,596 - INFO - assuming n2_h4_cc-pVDZ.93193d14-3f99-4495-bcf8-e60f9d863904.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:26:15,598 - INFO - parsing ../problem_instances/problem_instance.c2_h4_0.9fbd9b4c-5ea9-4095-af7b-7d4491399e42.json
-2024-12-14 15:26:15,598 - INFO - problem_instance UUID: 9fbd9b4c-5ea9-4095-af7b-7d4491399e42
-2024-12-14 15:26:15,598 - INFO - problem_instance short name: c2_h4_0
-2024-12-14 15:26:15,598 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:26:15,613 - INFO - Analyzing task 26423f2e-e3e1-4bbb-b2ff-52bdae87d65b...
-2024-12-14 15:26:15,614 - INFO - number of supporting files: 2
-2024-12-14 15:26:15,614 - INFO - supporting data file UUID: 40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.
-2024-12-14 15:26:15,614 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz.
-2024-12-14 15:26:15,614 - INFO - assuming fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz is an FCIDUMP file.
-2024-12-14 15:26:15,614 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz...
-2024-12-14 15:26:15,619 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:26:16,343 - INFO - Authentication (publickey) successful!
-2024-12-14 15:26:16,359 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:26:17,293 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:26:18,919 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 15:26:18,919 - INFO - supporting data file UUID: f563c847-e680-4452-8320-aa3b4e8aa3b7.
-2024-12-14 15:26:18,919 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h4_cc-pVDZ.f563c847-e680-4452-8320-aa3b4e8aa3b7.chk.
-2024-12-14 15:26:18,919 - INFO - assuming c2_h4_cc-pVDZ.f563c847-e680-4452-8320-aa3b4e8aa3b7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:26:18,919 - INFO - Analyzing task 9757b7c2-d420-4ebb-8da7-38238951a5ca...
-2024-12-14 15:26:18,919 - INFO - number of supporting files: 2
-2024-12-14 15:26:18,919 - INFO - supporting data file UUID: 4bd40563-25e1-4334-bf15-3ccd36c05ab2.
-2024-12-14 15:26:18,919 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz.
-2024-12-14 15:26:18,919 - INFO - assuming fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz is an FCIDUMP file.
-2024-12-14 15:26:18,919 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz...
-2024-12-14 15:26:19,002 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:26:19,657 - INFO - Authentication (publickey) successful!
-2024-12-14 15:26:19,673 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:27:58,090 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:28:44,660 - INFO - Skipping Logical Resource Estimate because number of orbitals (116) exceeds maximum specified in config (32).
-2024-12-14 15:28:44,660 - INFO - supporting data file UUID: d4db7859-f494-41d7-8658-56dcb50831b4.
-2024-12-14 15:28:44,660 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h4_cc-pVTZ.d4db7859-f494-41d7-8658-56dcb50831b4.chk.
-2024-12-14 15:28:44,660 - INFO - assuming c2_h4_cc-pVTZ.d4db7859-f494-41d7-8658-56dcb50831b4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:28:44,674 - INFO - parsing ../problem_instances/problem_instance.O_1.d712afaf-6ec4-42d9-b5fd-1edee3ec1046.json
-2024-12-14 15:28:44,674 - INFO - problem_instance UUID: d712afaf-6ec4-42d9-b5fd-1edee3ec1046
-2024-12-14 15:28:44,674 - INFO - problem_instance short name: O_1
-2024-12-14 15:28:44,674 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:28:44,686 - INFO - Analyzing task 752966e5-7de7-4506-82ae-6b22cd54b1c1...
-2024-12-14 15:28:44,686 - INFO - number of supporting files: 2
-2024-12-14 15:28:44,686 - INFO - supporting data file UUID: 0767fb16-25bd-4f1c-b134-6b536191b36e.
-2024-12-14 15:28:44,686 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz.
-2024-12-14 15:28:44,686 - INFO - assuming fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz is an FCIDUMP file.
-2024-12-14 15:28:44,686 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz...
-2024-12-14 15:28:44,692 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:28:45,357 - INFO - Authentication (publickey) successful!
-2024-12-14 15:28:45,373 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:28:45,439 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:28:45,548 - INFO - ===============================================
-2024-12-14 15:28:45,548 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 175 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 181 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 182 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 183 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 184 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 186 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 187 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 188 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 189 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 190 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 191 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 192 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 193 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 194 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 195 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 196 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 197 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 198 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 199 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 200 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 201 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 202 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:29:26,876 - INFO - Circuit initialization time: 41.327389 seconds.
-2024-12-14 15:29:26,876 - INFO - Estimating logical resources...
-2024-12-14 15:29:35,188 - INFO - Resource estimation time (seconds): 8.311919
-2024-12-14 15:29:35,188 - INFO - supporting data file UUID: db942588-339b-4fb6-a293-f853ebb812d7.
-2024-12-14 15:29:35,188 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vdz.db942588-339b-4fb6-a293-f853ebb812d7.chk.
-2024-12-14 15:29:35,188 - INFO - assuming O1_vdz.db942588-339b-4fb6-a293-f853ebb812d7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:29:35,189 - INFO - Analyzing task 64122cc6-e1bb-4c11-8d00-2189d27194f1...
-2024-12-14 15:29:35,189 - INFO - number of supporting files: 2
-2024-12-14 15:29:35,189 - INFO - supporting data file UUID: 3b587c2c-9579-4c7b-8b3f-e00c69c42981.
-2024-12-14 15:29:35,189 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz.
-2024-12-14 15:29:35,189 - INFO - assuming fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz is an FCIDUMP file.
-2024-12-14 15:29:35,189 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz...
-2024-12-14 15:29:35,193 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:29:35,826 - INFO - Authentication (publickey) successful!
-2024-12-14 15:29:35,844 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:29:46,200 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:30:02,298 - INFO - Skipping Logical Resource Estimate because number of orbitals (79) exceeds maximum specified in config (32).
-2024-12-14 15:30:02,298 - INFO - supporting data file UUID: 9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.
-2024-12-14 15:30:02,298 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vqz.9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.chk.
-2024-12-14 15:30:02,298 - INFO - assuming O1_vqz.9f9fdd09-bfd1-4771-a9b7-fbd854a6b0dc.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:30:02,298 - INFO - Analyzing task f9bdbb3b-91b6-43f3-93ca-bef1e10d3835...
-2024-12-14 15:30:02,298 - INFO - number of supporting files: 2
-2024-12-14 15:30:02,298 - INFO - supporting data file UUID: ee1c9912-bca9-42fa-a90d-421e9a26c785.
-2024-12-14 15:30:02,298 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz.
-2024-12-14 15:30:02,298 - INFO - assuming fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz is an FCIDUMP file.
-2024-12-14 15:30:02,298 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz...
-2024-12-14 15:30:02,303 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:30:02,951 - INFO - Authentication (publickey) successful!
-2024-12-14 15:30:02,968 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:30:03,213 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:30:04,940 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 15:30:04,940 - INFO - supporting data file UUID: b295de3f-c1ac-42ed-baf4-97cc52e0dba2.
-2024-12-14 15:30:04,940 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O1_vtz.b295de3f-c1ac-42ed-baf4-97cc52e0dba2.chk.
-2024-12-14 15:30:04,940 - INFO - assuming O1_vtz.b295de3f-c1ac-42ed-baf4-97cc52e0dba2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:30:04,942 - INFO - parsing ../problem_instances/problem_instance.cr_dimer.8ed1a800-a4c6-4bff-a6de-cb220554c42f.json
-2024-12-14 15:30:04,942 - INFO - problem_instance UUID: 8ed1a800-a4c6-4bff-a6de-cb220554c42f
-2024-12-14 15:30:04,942 - INFO - problem_instance short name: cr_dimer
-2024-12-14 15:30:04,942 - INFO - contains 12 associated Hamiltonians.
-2024-12-14 15:30:04,957 - INFO - Analyzing task 9030e9c9-0323-413c-a98e-aba16b180ba7...
-2024-12-14 15:30:04,957 - INFO - number of supporting files: 1
-2024-12-14 15:30:04,957 - INFO - supporting data file UUID: 3092dd74-660d-4c7a-9d43-16d1436e084b.
-2024-12-14 15:30:04,957 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz.
-2024-12-14 15:30:04,957 - INFO - assuming FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz is an FCIDUMP file.
-2024-12-14 15:30:04,957 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz...
-2024-12-14 15:30:04,962 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:30:05,622 - INFO - Authentication (publickey) successful!
-2024-12-14 15:30:05,641 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:30:05,700 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:30:05,753 - INFO - ===============================================
-2024-12-14 15:30:05,753 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 15:30:24,578 - INFO - Circuit initialization time: 18.825116 seconds.
-2024-12-14 15:30:24,579 - INFO - Estimating logical resources...
-2024-12-14 15:30:29,589 - INFO - Resource estimation time (seconds): 5.01002
-2024-12-14 15:30:29,589 - INFO - Analyzing task c7c653b0-4440-4a36-a66b-8b81a9a351c7...
-2024-12-14 15:30:29,589 - INFO - number of supporting files: 1
-2024-12-14 15:30:29,589 - INFO - supporting data file UUID: 96843098-e69d-4d1f-8a88-5b24826f7390.
-2024-12-14 15:30:29,589 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz.
-2024-12-14 15:30:29,589 - INFO - assuming FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz is an FCIDUMP file.
-2024-12-14 15:30:29,589 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz...
-2024-12-14 15:30:29,595 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:30:30,247 - INFO - Authentication (publickey) successful!
-2024-12-14 15:30:30,262 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:30:30,319 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:30:30,521 - INFO - ===============================================
-2024-12-14 15:30:30,521 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 15:31:47,904 - INFO - Circuit initialization time: 77.382228 seconds.
-2024-12-14 15:31:47,904 - INFO - Estimating logical resources...
-2024-12-14 15:32:03,450 - INFO - Resource estimation time (seconds): 15.546244
-2024-12-14 15:32:03,450 - INFO - Analyzing task 82f35801-6276-4090-a9aa-b821d94708d4...
-2024-12-14 15:32:03,450 - INFO - number of supporting files: 1
-2024-12-14 15:32:03,451 - INFO - supporting data file UUID: 673dfe91-d90e-4ecd-8560-d6d74de11070.
-2024-12-14 15:32:03,451 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz.
-2024-12-14 15:32:03,451 - INFO - assuming FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz is an FCIDUMP file.
-2024-12-14 15:32:03,451 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz...
-2024-12-14 15:32:03,458 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:32:04,124 - INFO - Authentication (publickey) successful!
-2024-12-14 15:32:04,146 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:32:07,373 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:32:16,969 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 15:32:16,969 - INFO - Analyzing task 362386c9-f0c2-483e-a64d-52208ab9bbc1...
-2024-12-14 15:32:16,969 - INFO - number of supporting files: 1
-2024-12-14 15:32:16,969 - INFO - supporting data file UUID: 4412b7d6-86db-4616-9dd2-2c32ee02560f.
-2024-12-14 15:32:16,969 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz.
-2024-12-14 15:32:16,969 - INFO - assuming FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz is an FCIDUMP file.
-2024-12-14 15:32:16,969 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz...
-2024-12-14 15:32:16,976 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:32:17,685 - INFO - Authentication (publickey) successful!
-2024-12-14 15:32:17,701 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:32:27,065 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:32:41,660 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 15:32:41,660 - INFO - Analyzing task 61ad4cfe-b057-4dd8-bd06-ed56347745c1...
-2024-12-14 15:32:41,660 - INFO - number of supporting files: 1
-2024-12-14 15:32:41,660 - INFO - supporting data file UUID: cdf017c4-7c30-4274-9567-f5e55a6ba857.
-2024-12-14 15:32:41,660 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz.
-2024-12-14 15:32:41,660 - INFO - assuming FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz is an FCIDUMP file.
-2024-12-14 15:32:41,660 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz...
-2024-12-14 15:32:41,664 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:32:42,325 - INFO - Authentication (publickey) successful!
-2024-12-14 15:32:42,342 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:32:42,394 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:32:42,448 - INFO - ===============================================
-2024-12-14 15:32:42,448 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 15:33:04,241 - INFO - Circuit initialization time: 21.792965 seconds.
-2024-12-14 15:33:04,242 - INFO - Estimating logical resources...
-2024-12-14 15:33:09,380 - INFO - Resource estimation time (seconds): 5.13869
-2024-12-14 15:33:09,381 - INFO - Analyzing task fc25a232-d249-4e1c-a9ec-360cab33f779...
-2024-12-14 15:33:09,381 - INFO - number of supporting files: 1
-2024-12-14 15:33:09,381 - INFO - supporting data file UUID: d9341cde-90e8-4d1e-beb2-4e40246d31ce.
-2024-12-14 15:33:09,381 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz.
-2024-12-14 15:33:09,381 - INFO - assuming FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz is an FCIDUMP file.
-2024-12-14 15:33:09,381 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz...
-2024-12-14 15:33:09,387 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:33:10,051 - INFO - Authentication (publickey) successful!
-2024-12-14 15:33:10,066 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:33:10,138 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:33:10,353 - INFO - ===============================================
-2024-12-14 15:33:10,353 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 293 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 295 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 297 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 298 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 299 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:34:39,499 - INFO - Circuit initialization time: 89.146106 seconds.
-2024-12-14 15:34:39,499 - INFO - Estimating logical resources...
-2024-12-14 15:34:55,050 - INFO - Resource estimation time (seconds): 15.550888
-2024-12-14 15:34:55,050 - INFO - Analyzing task b99ec02f-b46a-43fe-8a87-1b3286e072d8...
-2024-12-14 15:34:55,050 - INFO - number of supporting files: 1
-2024-12-14 15:34:55,050 - INFO - supporting data file UUID: 5439a548-153b-4990-be12-f0e33c30fe63.
-2024-12-14 15:34:55,051 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz.
-2024-12-14 15:34:55,051 - INFO - assuming FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz is an FCIDUMP file.
-2024-12-14 15:34:55,051 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz...
-2024-12-14 15:34:55,056 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:34:55,728 - INFO - Authentication (publickey) successful!
-2024-12-14 15:34:55,746 - INFO - [chan 0] Opened sftp connection (server version 3)
-Downloading gsee/small_molecules/fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz to fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b.gz...
-Parsing fcidump.li2_cc-pVDZ.243670ee-2d2e-4d90-abc1-16938a04a80b
-Downloading gsee/small_molecules/fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz to fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b.gz...
-Parsing fcidump.li2_cc-pVQZ.6224abe8-831e-4b52-b8d9-8ebac0a35c2b
-Downloading gsee/small_molecules/fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz to fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2.gz...
-Parsing fcidump.li2_cc-pVTZ.26d2547c-96a4-400d-9528-9987ae6699b2
-Downloading gsee/small_molecules/fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz to fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7.gz...
-Parsing fcidump.h_f_cc-pVDZ.b93a2eeb-79c3-4f98-8919-f5e0aaedcea7
-Downloading gsee/small_molecules/fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz to fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc.gz...
-Parsing fcidump.h_f_cc-pVQZ.ff2ff7dd-2eb8-4565-a59e-76a47db07fbc
-Downloading gsee/small_molecules/fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz to fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488.gz...
-Parsing fcidump.h_f_cc-pVTZ.819ffa8e-51ee-4e78-aa07-17686d7a9488
-Downloading gsee/small_molecules/fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz to fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3.gz...
-Parsing fcidump.Fe0_vdz.133ec573-3d06-4582-b2f5-8afe8be8dbe3
-Downloading gsee/small_molecules/fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz to fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5.gz...
-Parsing fcidump.Fe0_vtz.cb274492-6acb-4426-a4f6-8cb4a8cef3c5
-Downloading gsee/planted_solutions/fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz to fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7.gz...
-Parsing fcidump.planted_solution_0010.eea867d0-285e-462d-94ab-15579c782be7
-Downloading gsee/fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz to fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74.gz...
-Parsing fcidump.2_co2_0.2_old.1dc29784-ab7f-45a1-9821-31fea4363d74
-Downloading gsee/fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz to fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2.gz...
-Parsing fcidump.7_melact_0.2_old.5dbed2ac-f9a4-4afe-9b18-f67378a51fb2
-Downloading gsee/fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz to fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd.gz...
-Parsing fcidump.8_melact_0.2_old.587f69a8-4295-4d6d-811e-0eacfbc5f6dd
-Downloading gsee/fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz to fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2.gz...
-Parsing fcidump.0_ru_macho_noncan_0.2_new.46aea10c-d57f-4133-9837-3c57d474d9a2
-Downloading gsee/fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz to fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5.gz...
-Parsing fcidump.1_ru_macho_noncan_0.2_new.496aaf89-2cdf-43cf-8b25-246e915cc8b5
-Downloading gsee/fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz to fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7.gz...
-Parsing fcidump.3_ts_ru_macho_co2_noncan_0.2_new.0d7e4a74-fd11-46e3-ba22-044a7ebc54c7
-Downloading gsee/fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz to fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d.gz...
-Parsing fcidump.4_ts_ru_macho_co2_noncan_0.2_new.e5e63f77-dbaa-431c-a53f-93c0f4c0758d
-Downloading gsee/fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz to fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268.gz...
-Parsing fcidump.5_ts_ru_macho_melact_noncan_0.2_new.d7bea809-6e34-49f8-8daf-8d728dd18268
-Downloading gsee/fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz to fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5.gz...
-Parsing fcidump.6_ts_ru_macho_melact_noncan_0.2_new.73ae455f-a729-4fac-a626-5654b03c1ef5
-Downloading gsee/small_molecules/fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz to fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec.gz...
-Parsing fcidump.Cu1_vdz.6facf2d4-6cb3-49b6-8b66-3bd21c1461ec
-Downloading gsee/small_molecules/fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz to fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89.gz...
-Parsing fcidump.Cu1_vtz.68952c71-d281-40fa-bcd2-cb0352f70a89
-Downloading gsee/small_molecules/fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz to fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd.gz...
-Parsing fcidump.n_h3_cc-pVDZ.9820e181-088a-4b00-8a14-8cafb952ccdd
-Downloading gsee/small_molecules/fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz to fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6.gz...
-Parsing fcidump.n_h3_cc-pVTZ.3b423f54-aa64-4331-a59b-d6c37de1fbb6
-Downloading gsee/planted_solutions/fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz to fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781.gz...
-Parsing fcidump.planted_solution_0006.a4b9a6bd-4479-44b2-b172-642f74396781
-Downloading gsee/small_molecules/fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz to fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94.gz...
-Parsing fcidump.n2_h4_cc-pVDZ.aba33661-3ce8-4f28-824f-e98244906d94
-Downloading gsee/small_molecules/fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz to fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d.gz...
-Parsing fcidump.c2_h4_cc-pVDZ.40035d66-75b8-4b6e-95e5-8b1a3ff1a61d
-Downloading gsee/small_molecules/fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz to fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2.gz...
-Parsing fcidump.c2_h4_cc-pVTZ.4bd40563-25e1-4334-bf15-3ccd36c05ab2
-Downloading gsee/small_molecules/fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz to fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e.gz...
-Parsing fcidump.O1_vdz.0767fb16-25bd-4f1c-b134-6b536191b36e
-Downloading gsee/small_molecules/fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz to fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981.gz...
-Parsing fcidump.O1_vqz.3b587c2c-9579-4c7b-8b3f-e00c69c42981
-Downloading gsee/small_molecules/fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz to fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785.gz...
-Parsing fcidump.O1_vtz.ee1c9912-bca9-42fa-a90d-421e9a26c785
-Downloading gsee/FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz to FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b.gz...
-Parsing FCIDUMP_d_1.68_b_sto-3g_ne_12.3092dd74-660d-4c7a-9d43-16d1436e084b
-Downloading gsee/FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz to FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390.gz...
-Parsing FCIDUMP_d_1.68_b_sto-3g_ne_28.96843098-e69d-4d1f-8a88-5b24826f7390
-Downloading gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz to FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070.gz...
-Parsing FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_12.673dfe91-d90e-4ecd-8560-d6d74de11070
-Downloading gsee/FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz to FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f.gz...
-Parsing FCIDUMP_d_1.68_b_cc-pvdz-dk_ne_28.4412b7d6-86db-4616-9dd2-2c32ee02560f
-Downloading gsee/FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz to FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857.gz...
-Parsing FCIDUMP_d_2.0_b_sto-3g_ne_12.cdf017c4-7c30-4274-9567-f5e55a6ba857
-Downloading gsee/FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz to FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce.gz...
-Parsing FCIDUMP_d_2.0_b_sto-3g_ne_28.d9341cde-90e8-4d1e-beb2-4e40246d31ce
-2024-12-14 15:34:58,521 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:35:08,089 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 15:35:08,090 - INFO - Analyzing task 8874bf11-f594-41df-b8a0-d2a7441904a1...
-2024-12-14 15:35:08,090 - INFO - number of supporting files: 1
-2024-12-14 15:35:08,090 - INFO - supporting data file UUID: e2995852-9911-4021-a82f-5b14ddb2d5c8.
-2024-12-14 15:35:08,090 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz.
-2024-12-14 15:35:08,090 - INFO - assuming FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz is an FCIDUMP file.
-2024-12-14 15:35:08,090 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz...
-2024-12-14 15:35:08,096 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:35:08,579 - INFO - Authentication (publickey) successful!
-2024-12-14 15:35:08,593 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:35:16,152 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:35:30,736 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 15:35:30,736 - INFO - Analyzing task 202e6184-1e7d-4c02-a82a-f588b6abf809...
-2024-12-14 15:35:30,736 - INFO - number of supporting files: 1
-2024-12-14 15:35:30,736 - INFO - supporting data file UUID: 67acc90d-1a9e-49a7-98a1-8ca643dca272.
-2024-12-14 15:35:30,736 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz.
-2024-12-14 15:35:30,736 - INFO - assuming FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz is an FCIDUMP file.
-2024-12-14 15:35:30,736 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz...
-2024-12-14 15:35:30,741 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:35:31,403 - INFO - Authentication (publickey) successful!
-2024-12-14 15:35:31,427 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:35:31,710 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:35:31,762 - INFO - ===============================================
-2024-12-14 15:35:31,762 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 155 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:35:51,918 - INFO - Circuit initialization time: 20.156168 seconds.
-2024-12-14 15:35:51,918 - INFO - Estimating logical resources...
-2024-12-14 15:35:57,084 - INFO - Resource estimation time (seconds): 5.166171
-2024-12-14 15:35:57,085 - INFO - Analyzing task 7c8f0a36-cda5-4b33-bb46-4e58a15b37a1...
-2024-12-14 15:35:57,085 - INFO - number of supporting files: 1
-2024-12-14 15:35:57,085 - INFO - supporting data file UUID: 01d526fb-276e-4369-85d4-66a553a1d02e.
-2024-12-14 15:35:57,085 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz.
-2024-12-14 15:35:57,085 - INFO - assuming FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz is an FCIDUMP file.
-2024-12-14 15:35:57,085 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz...
-2024-12-14 15:35:57,090 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:35:57,754 - INFO - Authentication (publickey) successful!
-2024-12-14 15:35:57,768 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:35:57,829 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:35:58,032 - INFO - ===============================================
-2024-12-14 15:35:58,032 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 273 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:37:22,831 - INFO - Circuit initialization time: 84.798385 seconds.
-2024-12-14 15:37:22,831 - INFO - Estimating logical resources...
-2024-12-14 15:37:37,307 - INFO - Resource estimation time (seconds): 14.476388
-2024-12-14 15:37:37,308 - INFO - Analyzing task cbab5937-5e2f-4f3f-819e-ede8b66d7238...
-2024-12-14 15:37:37,308 - INFO - number of supporting files: 1
-2024-12-14 15:37:37,308 - INFO - supporting data file UUID: b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.
-2024-12-14 15:37:37,308 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz.
-2024-12-14 15:37:37,308 - INFO - assuming FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz is an FCIDUMP file.
-2024-12-14 15:37:37,308 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz...
-2024-12-14 15:37:37,313 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:37:37,992 - INFO - Authentication (publickey) successful!
-2024-12-14 15:37:38,007 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:37:42,934 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:37:52,316 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 15:37:52,317 - INFO - Analyzing task c28e09e1-5983-42f7-9ecb-b271438ebcc8...
-2024-12-14 15:37:52,317 - INFO - number of supporting files: 1
-2024-12-14 15:37:52,317 - INFO - supporting data file UUID: 2101e6fa-9fb3-4697-98be-25a4e0de2079.
-2024-12-14 15:37:52,317 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz.
-2024-12-14 15:37:52,317 - INFO - assuming FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz is an FCIDUMP file.
-2024-12-14 15:37:52,317 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz...
-2024-12-14 15:37:52,322 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:37:52,996 - INFO - Authentication (publickey) successful!
-2024-12-14 15:37:53,011 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:38:00,514 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:38:14,983 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 15:38:14,986 - INFO - parsing ../problem_instances/problem_instance.be_0.19cada59-64cc-466c-8809-782a4f574dcc.json
-2024-12-14 15:38:14,986 - INFO - problem_instance UUID: 19cada59-64cc-466c-8809-782a4f574dcc
-2024-12-14 15:38:14,986 - INFO - problem_instance short name: be_0
-2024-12-14 15:38:14,986 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:38:15,001 - INFO - Skipping task 3fb92ecd-bcbc-43dd-9f29-aa56ea646b75 because no overlap was provided.
-2024-12-14 15:38:15,002 - INFO - Analyzing task afdc2f74-eb52-41ae-b72a-30e5a4c07013...
-2024-12-14 15:38:15,002 - INFO - number of supporting files: 2
-2024-12-14 15:38:15,002 - INFO - supporting data file UUID: f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.
-2024-12-14 15:38:15,002 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz.
-2024-12-14 15:38:15,002 - INFO - assuming fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz is an FCIDUMP file.
-2024-12-14 15:38:15,002 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz...
-2024-12-14 15:38:15,007 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:38:15,498 - INFO - Authentication (publickey) successful!
-2024-12-14 15:38:15,513 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:38:16,156 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:38:18,998 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 15:38:18,998 - INFO - supporting data file UUID: 26c5cd51-33c9-4c10-969e-07daa488861d.
-2024-12-14 15:38:18,998 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/be_cc-pVQZ.26c5cd51-33c9-4c10-969e-07daa488861d.chk.
-2024-12-14 15:38:18,998 - INFO - assuming be_cc-pVQZ.26c5cd51-33c9-4c10-969e-07daa488861d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:38:18,999 - INFO - Analyzing task 543e2ed4-a12d-495b-a246-1e4d905ad4a3...
-2024-12-14 15:38:18,999 - INFO - number of supporting files: 2
-2024-12-14 15:38:18,999 - INFO - supporting data file UUID: fdc83bd0-c9bd-47da-abee-99b743b36494.
-2024-12-14 15:38:18,999 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz.
-2024-12-14 15:38:18,999 - INFO - assuming fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz is an FCIDUMP file.
-2024-12-14 15:38:18,999 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz...
-2024-12-14 15:38:19,006 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:38:19,670 - INFO - Authentication (publickey) successful!
-2024-12-14 15:38:19,685 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:38:19,781 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:38:20,107 - INFO - ===============================================
-2024-12-14 15:38:20,107 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 293 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 297 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 301 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 302 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 303 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 304 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 305 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 306 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 307 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 308 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 309 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 310 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 311 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 312 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 313 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 314 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:40:34,370 - INFO - Circuit initialization time: 134.262801 seconds.
-2024-12-14 15:40:34,371 - INFO - Estimating logical resources...
-2024-12-14 15:40:53,199 - INFO - Resource estimation time (seconds): 18.828209
-2024-12-14 15:40:53,199 - INFO - supporting data file UUID: fedfefb8-56ab-4bf5-8607-fe3950fd5962.
-2024-12-14 15:40:53,199 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/be_cc-pVTZ.fedfefb8-56ab-4bf5-8607-fe3950fd5962.chk.
-2024-12-14 15:40:53,199 - INFO - assuming be_cc-pVTZ.fedfefb8-56ab-4bf5-8607-fe3950fd5962.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:40:53,201 - INFO - parsing ../problem_instances/problem_instance.f2_0.e3e78b41-577d-4536-a63f-7e968eeb6493.json
-2024-12-14 15:40:53,201 - INFO - problem_instance UUID: e3e78b41-577d-4536-a63f-7e968eeb6493
-2024-12-14 15:40:53,202 - INFO - problem_instance short name: f2_0
-2024-12-14 15:40:53,202 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:40:53,217 - INFO - Analyzing task 94fc2317-29af-43a1-aaec-dade9850ca27...
-2024-12-14 15:40:53,217 - INFO - number of supporting files: 2
-2024-12-14 15:40:53,217 - INFO - supporting data file UUID: ac269a87-2bc4-458e-8f4a-64f524c77044.
-2024-12-14 15:40:53,217 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz.
-2024-12-14 15:40:53,217 - INFO - assuming fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz is an FCIDUMP file.
-2024-12-14 15:40:53,217 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz...
-2024-12-14 15:40:53,230 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:40:53,876 - INFO - Authentication (publickey) successful!
-2024-12-14 15:40:53,891 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:40:53,969 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:40:54,249 - INFO - ===============================================
-2024-12-14 15:40:54,249 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 273 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 274 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 275 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 276 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 277 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 278 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 279 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 280 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 281 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 282 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 283 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 284 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 285 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 286 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 287 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 288 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 289 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 290 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 291 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:42:16,214 - INFO - Circuit initialization time: 81.964277 seconds.
-2024-12-14 15:42:16,214 - INFO - Estimating logical resources...
-2024-12-14 15:42:32,729 - INFO - Resource estimation time (seconds): 16.514769
-2024-12-14 15:42:32,729 - INFO - supporting data file UUID: 6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.
-2024-12-14 15:42:32,729 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVDZ.6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.chk.
-2024-12-14 15:42:32,729 - INFO - assuming f2_cc-pVDZ.6f7d1bce-200d-46a7-a655-d1e01cdfa6c1.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:42:32,729 - INFO - Analyzing task fa8e83f2-cec5-4609-9b77-d713608a6b53...
-2024-12-14 15:42:32,729 - INFO - number of supporting files: 2
-2024-12-14 15:42:32,729 - INFO - supporting data file UUID: 29d645f8-ce30-4e18-9f41-644ac5f9d922.
-2024-12-14 15:42:32,729 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz.
-2024-12-14 15:42:32,729 - INFO - assuming fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz is an FCIDUMP file.
-2024-12-14 15:42:32,729 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz...
-2024-12-14 15:42:32,735 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:42:33,393 - INFO - Authentication (publickey) successful!
-2024-12-14 15:42:33,407 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:44:32,182 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:45:30,967 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 15:45:30,967 - INFO - supporting data file UUID: 5c169867-7d8c-44d8-8b34-4ecc34cd9649.
-2024-12-14 15:45:30,967 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVQZ.5c169867-7d8c-44d8-8b34-4ecc34cd9649.chk.
-2024-12-14 15:45:30,967 - INFO - assuming f2_cc-pVQZ.5c169867-7d8c-44d8-8b34-4ecc34cd9649.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:45:30,968 - INFO - Analyzing task 3fb371ad-c738-40ae-b9ae-80e5bce8f2ac...
-2024-12-14 15:45:30,968 - INFO - number of supporting files: 2
-2024-12-14 15:45:30,968 - INFO - supporting data file UUID: 3c3967d4-17c1-4947-9465-b9223b01e694.
-2024-12-14 15:45:30,968 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz.
-2024-12-14 15:45:30,968 - INFO - assuming fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz is an FCIDUMP file.
-2024-12-14 15:45:30,968 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz...
-2024-12-14 15:45:30,973 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:45:31,635 - INFO - Authentication (publickey) successful!
-2024-12-14 15:45:31,648 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:45:32,748 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:45:37,838 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 15:45:37,839 - INFO - supporting data file UUID: 8627efa5-5412-4e91-9cd0-2a582c3c7c20.
-2024-12-14 15:45:37,839 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/f2_cc-pVTZ.8627efa5-5412-4e91-9cd0-2a582c3c7c20.chk.
-2024-12-14 15:45:37,839 - INFO - assuming f2_cc-pVTZ.8627efa5-5412-4e91-9cd0-2a582c3c7c20.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:45:37,843 - INFO - parsing ../problem_instances/problem_instance.n2_0.9bd9cde6-6daa-441a-984e-ae1c1c051e91.json
-2024-12-14 15:45:37,843 - INFO - problem_instance UUID: 9bd9cde6-6daa-441a-984e-ae1c1c051e91
-2024-12-14 15:45:37,843 - INFO - problem_instance short name: n2_0
-2024-12-14 15:45:37,843 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 15:45:37,865 - INFO - Analyzing task b9c35349-927d-47d5-8e0c-e054bbf4e4e0...
-2024-12-14 15:45:37,865 - INFO - number of supporting files: 2
-2024-12-14 15:45:37,865 - INFO - supporting data file UUID: 60c52c22-d27a-4544-8b9c-6022507611f9.
-2024-12-14 15:45:37,865 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz.
-2024-12-14 15:45:37,865 - INFO - assuming fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz is an FCIDUMP file.
-2024-12-14 15:45:37,865 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz...
-2024-12-14 15:45:37,872 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:45:38,525 - INFO - Authentication (publickey) successful!
-2024-12-14 15:45:38,539 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:45:38,609 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:45:38,855 - INFO - ===============================================
-2024-12-14 15:45:38,855 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 320 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 321 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 322 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 323 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 324 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 325 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 326 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 327 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 328 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 329 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:47:00,082 - INFO - Circuit initialization time: 81.226787 seconds.
-2024-12-14 15:47:00,083 - INFO - Estimating logical resources...
-2024-12-14 15:47:17,749 - INFO - Resource estimation time (seconds): 17.6651
-2024-12-14 15:47:17,749 - INFO - supporting data file UUID: a107e4ce-0b43-437a-8c59-c2c249d1798d.
-2024-12-14 15:47:17,749 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVDZ.a107e4ce-0b43-437a-8c59-c2c249d1798d.chk.
-2024-12-14 15:47:17,749 - INFO - assuming n2_cc-pVDZ.a107e4ce-0b43-437a-8c59-c2c249d1798d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:47:17,749 - INFO - Analyzing task 9eed79e4-b195-4474-b280-fe9166a7a241...
-2024-12-14 15:47:17,749 - INFO - number of supporting files: 2
-2024-12-14 15:47:17,749 - INFO - supporting data file UUID: e84ef191-bfe0-4859-96b9-0613cad743d4.
-2024-12-14 15:47:17,749 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz.
-2024-12-14 15:47:17,749 - INFO - assuming fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz is an FCIDUMP file.
-2024-12-14 15:47:17,749 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz...
-2024-12-14 15:47:17,755 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:47:18,390 - INFO - Authentication (publickey) successful!
-2024-12-14 15:47:18,405 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:49:01,905 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:49:57,732 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 15:49:57,733 - INFO - supporting data file UUID: bb706eb0-f001-4938-8b70-b9f742942f45.
-2024-12-14 15:49:57,733 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVQZ.bb706eb0-f001-4938-8b70-b9f742942f45.chk.
-2024-12-14 15:49:57,733 - INFO - assuming n2_cc-pVQZ.bb706eb0-f001-4938-8b70-b9f742942f45.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:49:57,733 - INFO - Analyzing task 666185aa-b65d-4f73-8846-ae9693388d9d...
-2024-12-14 15:49:57,733 - INFO - number of supporting files: 2
-2024-12-14 15:49:57,733 - INFO - supporting data file UUID: 48512c28-04a3-4e3b-b6b2-3e4b654c1887.
-2024-12-14 15:49:57,733 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz.
-2024-12-14 15:49:57,733 - INFO - assuming fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz is an FCIDUMP file.
-2024-12-14 15:49:57,733 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz...
-2024-12-14 15:49:57,742 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:49:58,378 - INFO - Authentication (publickey) successful!
-2024-12-14 15:49:58,392 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:49:59,280 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:04,098 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 15:50:04,098 - INFO - supporting data file UUID: 5235f91b-19a0-4122-b54f-99051ccf0480.
-2024-12-14 15:50:04,098 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/n2_cc-pVTZ.5235f91b-19a0-4122-b54f-99051ccf0480.chk.
-2024-12-14 15:50:04,098 - INFO - assuming n2_cc-pVTZ.5235f91b-19a0-4122-b54f-99051ccf0480.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:50:04,100 - INFO - parsing ../problem_instances/problem_instance.fe_red.a8895776-3583-4884-fbc7-d6f9df21a7ac.json
-2024-12-14 15:50:04,101 - INFO - problem_instance UUID: a8895776-3583-4884-fbc7-d6f9df21a7ac
-2024-12-14 15:50:04,101 - INFO - problem_instance short name: fe_red
-2024-12-14 15:50:04,101 - INFO - contains 9 associated Hamiltonians.
-2024-12-14 15:50:04,116 - INFO - Analyzing task 4970c526-817f-4c04-8d7e-797526d5948d...
-2024-12-14 15:50:04,116 - INFO - number of supporting files: 1
-2024-12-14 15:50:04,116 - INFO - supporting data file UUID: 79e71b3e-6364-4972-b4b3-07841fa8ba97.
-2024-12-14 15:50:04,116 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz.
-2024-12-14 15:50:04,117 - INFO - assuming fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz is an FCIDUMP file.
-2024-12-14 15:50:04,117 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz...
-2024-12-14 15:50:04,122 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:04,780 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:04,800 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:05,046 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:06,846 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 15:50:06,846 - INFO - Analyzing task d27fb590-4e90-4d5a-bdb8-37fbf22f528b...
-2024-12-14 15:50:06,846 - INFO - number of supporting files: 1
-2024-12-14 15:50:06,846 - INFO - supporting data file UUID: e8f72c80-2fde-4bdc-ac1e-07220942f1c2.
-2024-12-14 15:50:06,846 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz.
-2024-12-14 15:50:06,846 - INFO - assuming fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz is an FCIDUMP file.
-2024-12-14 15:50:06,846 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz...
-2024-12-14 15:50:06,851 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:07,536 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:07,553 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:08,059 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:10,533 - INFO - Skipping Logical Resource Estimate because number of orbitals (53) exceeds maximum specified in config (32).
-2024-12-14 15:50:10,533 - INFO - Analyzing task a7cd2501-2f67-4fcd-b428-f6620f3596fe...
-2024-12-14 15:50:10,533 - INFO - number of supporting files: 1
-2024-12-14 15:50:10,533 - INFO - supporting data file UUID: 4854c3ff-b3ce-462b-ab8e-0b132cd880d0.
-2024-12-14 15:50:10,533 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz.
-2024-12-14 15:50:10,533 - INFO - assuming fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz is an FCIDUMP file.
-2024-12-14 15:50:10,533 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz...
-2024-12-14 15:50:10,538 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:11,179 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:11,197 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:12,105 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:17,000 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 15:50:17,000 - INFO - Analyzing task d3bcc63c-57ad-4346-8290-e36447186440...
-2024-12-14 15:50:17,000 - INFO - number of supporting files: 1
-2024-12-14 15:50:17,000 - INFO - supporting data file UUID: 379a0693-4ac3-4ff0-be33-7be3f6cad84f.
-2024-12-14 15:50:17,000 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz.
-2024-12-14 15:50:17,000 - INFO - assuming fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz is an FCIDUMP file.
-2024-12-14 15:50:17,000 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz...
-2024-12-14 15:50:17,006 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:17,682 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:17,697 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:17,980 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:19,623 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 15:50:19,623 - INFO - Analyzing task 41907f9f-923d-49e3-80a9-519962110ae7...
-2024-12-14 15:50:19,623 - INFO - number of supporting files: 1
-2024-12-14 15:50:19,623 - INFO - supporting data file UUID: 22ab7092-61bb-401f-ac43-912ec10ea48b.
-2024-12-14 15:50:19,623 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz.
-2024-12-14 15:50:19,623 - INFO - assuming fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz is an FCIDUMP file.
-2024-12-14 15:50:19,624 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz...
-2024-12-14 15:50:19,628 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:20,303 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:20,317 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:20,986 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:24,727 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:50:24,727 - INFO - Analyzing task ad9ceeaf-d7be-46b7-95a9-15bfd33f5022...
-2024-12-14 15:50:24,727 - INFO - number of supporting files: 1
-2024-12-14 15:50:24,727 - INFO - supporting data file UUID: 8a8780b0-a0ba-4b7e-9847-589302123e86.
-2024-12-14 15:50:24,727 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz.
-2024-12-14 15:50:24,728 - INFO - assuming fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz is an FCIDUMP file.
-2024-12-14 15:50:24,728 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz...
-2024-12-14 15:50:24,738 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:25,399 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:25,412 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:26,060 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:30,107 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 15:50:30,107 - INFO - Analyzing task adecdd92-73c7-416d-90da-b7a3da7ed50b...
-2024-12-14 15:50:30,107 - INFO - number of supporting files: 1
-2024-12-14 15:50:30,107 - INFO - supporting data file UUID: e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.
-2024-12-14 15:50:30,107 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz.
-2024-12-14 15:50:30,107 - INFO - assuming fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz is an FCIDUMP file.
-2024-12-14 15:50:30,107 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz...
-2024-12-14 15:50:30,112 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:30,757 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:30,778 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:30,970 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:32,581 - INFO - Skipping Logical Resource Estimate because number of orbitals (44) exceeds maximum specified in config (32).
-2024-12-14 15:50:32,581 - INFO - Analyzing task 03c70feb-49b8-4113-831a-05e3ae55c66b...
-2024-12-14 15:50:32,581 - INFO - number of supporting files: 1
-2024-12-14 15:50:32,581 - INFO - supporting data file UUID: eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.
-2024-12-14 15:50:32,581 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz.
-2024-12-14 15:50:32,582 - INFO - assuming fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz is an FCIDUMP file.
-2024-12-14 15:50:32,582 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz...
-2024-12-14 15:50:32,586 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:33,251 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:33,267 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:33,908 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:37,618 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:50:37,618 - INFO - Analyzing task 0e936335-6370-4587-92f0-02eafaf650ed...
-2024-12-14 15:50:37,619 - INFO - number of supporting files: 1
-2024-12-14 15:50:37,619 - INFO - supporting data file UUID: 5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.
-2024-12-14 15:50:37,619 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz.
-2024-12-14 15:50:37,619 - INFO - assuming fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz is an FCIDUMP file.
-2024-12-14 15:50:37,619 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz...
-2024-12-14 15:50:37,624 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:38,289 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:38,305 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:39,339 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:43,290 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 15:50:43,292 - INFO - parsing ../problem_instances/problem_instance.Fe_1.33c9a058-7a67-454c-856c-2519ba55b44d.json
-2024-12-14 15:50:43,292 - INFO - problem_instance UUID: 33c9a058-7a67-454c-856c-2519ba55b44d
-2024-12-14 15:50:43,292 - INFO - problem_instance short name: Fe_1
-2024-12-14 15:50:43,292 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:50:43,307 - INFO - Analyzing task a7e26b10-bd6b-457c-978e-9050f6529007...
-2024-12-14 15:50:43,308 - INFO - number of supporting files: 2
-2024-12-14 15:50:43,308 - INFO - supporting data file UUID: b57e3b82-2511-4c00-a850-f6aeba98b0b2.
-2024-12-14 15:50:43,308 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz.
-2024-12-14 15:50:43,308 - INFO - assuming fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz is an FCIDUMP file.
-2024-12-14 15:50:43,308 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz...
-2024-12-14 15:50:43,312 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:43,949 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:43,966 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:44,735 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:50:48,465 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:50:48,465 - INFO - supporting data file UUID: eaab709a-c628-4295-85d0-412071d1d7cc.
-2024-12-14 15:50:48,465 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe1_vdz.eaab709a-c628-4295-85d0-412071d1d7cc.chk.
-2024-12-14 15:50:48,466 - INFO - assuming Fe1_vdz.eaab709a-c628-4295-85d0-412071d1d7cc.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:50:48,466 - INFO - Analyzing task 6ab8d16c-b8f3-4780-b278-dad81646ca8c...
-2024-12-14 15:50:48,466 - INFO - number of supporting files: 2
-2024-12-14 15:50:48,466 - INFO - supporting data file UUID: b9615d62-11ee-49f7-8df4-df94466b2211.
-2024-12-14 15:50:48,466 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz.
-2024-12-14 15:50:48,466 - INFO - assuming fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz is an FCIDUMP file.
-2024-12-14 15:50:48,466 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz...
-2024-12-14 15:50:48,471 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:50:49,106 - INFO - Authentication (publickey) successful!
-2024-12-14 15:50:49,121 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:50:59,333 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:51:15,516 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 15:51:15,516 - INFO - supporting data file UUID: 7421b0eb-3b7f-42d6-ae6b-6583666b38e2.
-2024-12-14 15:51:15,516 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Fe1_vtz.7421b0eb-3b7f-42d6-ae6b-6583666b38e2.chk.
-2024-12-14 15:51:15,516 - INFO - assuming Fe1_vtz.7421b0eb-3b7f-42d6-ae6b-6583666b38e2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:51:15,523 - INFO - parsing ../problem_instances/problem_instance.ScO_0.7437abf0-1394-47ce-9218-d181f1732112.json
-2024-12-14 15:51:15,523 - INFO - problem_instance UUID: 7437abf0-1394-47ce-9218-d181f1732112
-2024-12-14 15:51:15,523 - INFO - problem_instance short name: ScO_0
-2024-12-14 15:51:15,523 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:51:15,538 - INFO - Analyzing task 9fa4fc3a-b0b9-4eaa-99ee-0469ae5a511d...
-2024-12-14 15:51:15,539 - INFO - number of supporting files: 2
-2024-12-14 15:51:15,539 - INFO - supporting data file UUID: 987498ce-5b91-4df6-924c-82d4841c17c2.
-2024-12-14 15:51:15,539 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz.
-2024-12-14 15:51:15,539 - INFO - assuming fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz is an FCIDUMP file.
-2024-12-14 15:51:15,539 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz...
-2024-12-14 15:51:15,553 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:51:16,125 - INFO - Authentication (publickey) successful!
-2024-12-14 15:51:16,142 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:51:21,569 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:51:33,715 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 15:51:33,715 - INFO - supporting data file UUID: 249d53eb-a925-4b2b-92eb-5a7b05c39069.
-2024-12-14 15:51:33,715 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/ScO_vdz.249d53eb-a925-4b2b-92eb-5a7b05c39069.chk.
-2024-12-14 15:51:33,715 - INFO - assuming ScO_vdz.249d53eb-a925-4b2b-92eb-5a7b05c39069.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:51:33,717 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0003.a37c86c0-1937-4f05-83ab-08a5fd104b7e.json
-2024-12-14 15:51:33,717 - INFO - problem_instance UUID: a37c86c0-1937-4f05-83ab-08a5fd104b7e
-2024-12-14 15:51:33,717 - INFO - problem_instance short name: planted_solution_0003
-2024-12-14 15:51:33,717 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:51:33,732 - INFO - Analyzing task 472bbfb1-c081-4df6-b966-32ce1194ab8c...
-2024-12-14 15:51:33,732 - INFO - number of supporting files: 1
-2024-12-14 15:51:33,732 - INFO - supporting data file UUID: efddd28a-383d-4929-9335-22e54ba2ffbe.
-2024-12-14 15:51:33,732 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz.
-2024-12-14 15:51:33,733 - INFO - assuming fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz is an FCIDUMP file.
-2024-12-14 15:51:33,733 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz...
-2024-12-14 15:51:33,737 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:51:34,238 - INFO - Authentication (publickey) successful!
-2024-12-14 15:51:34,251 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:51:34,336 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:51:34,702 - INFO - ===============================================
-2024-12-14 15:51:34,702 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 96 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 100 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 101 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 102 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 103 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 104 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 105 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 106 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 107 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 108 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 109 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 15:54:54,866 - INFO - Circuit initialization time: 200.164215 seconds.
-2024-12-14 15:54:54,867 - INFO - Estimating logical resources...
-2024-12-14 15:55:01,660 - INFO - Resource estimation time (seconds): 6.793141
-2024-12-14 15:55:01,662 - INFO - parsing ../problem_instances/problem_instance.h_c_n_0.8846a90e-96cb-4bc3-ad06-5388212f728e.json
-2024-12-14 15:55:01,662 - INFO - problem_instance UUID: 8846a90e-96cb-4bc3-ad06-5388212f728e
-2024-12-14 15:55:01,662 - INFO - problem_instance short name: h_c_n_0
-2024-12-14 15:55:01,662 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:55:01,678 - INFO - Analyzing task 94db0c2c-89f6-4c3d-b886-a3a6a2bdad1d...
-2024-12-14 15:55:01,678 - INFO - number of supporting files: 2
-2024-12-14 15:55:01,678 - INFO - supporting data file UUID: 8ab023ed-7cdf-49e6-87d9-369a13f2ac82.
-2024-12-14 15:55:01,678 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz.
-2024-12-14 15:55:01,678 - INFO - assuming fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz is an FCIDUMP file.
-2024-12-14 15:55:01,678 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz...
-2024-12-14 15:55:01,777 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:55:02,414 - INFO - Authentication (publickey) successful!
-2024-12-14 15:55:02,429 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:55:02,703 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:55:03,226 - INFO - Skipping Logical Resource Estimate because number of orbitals (33) exceeds maximum specified in config (32).
-2024-12-14 15:55:03,227 - INFO - supporting data file UUID: 46053168-a236-4e18-a305-965bdce3e019.
-2024-12-14 15:55:03,227 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_c_n_cc-pVDZ.46053168-a236-4e18-a305-965bdce3e019.chk.
-2024-12-14 15:55:03,227 - INFO - assuming h_c_n_cc-pVDZ.46053168-a236-4e18-a305-965bdce3e019.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:55:03,227 - INFO - Analyzing task c5ef4702-fc8d-4168-b594-8d5872fdb523...
-2024-12-14 15:55:03,227 - INFO - number of supporting files: 2
-2024-12-14 15:55:03,227 - INFO - supporting data file UUID: 6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.
-2024-12-14 15:55:03,227 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz.
-2024-12-14 15:55:03,227 - INFO - assuming fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz is an FCIDUMP file.
-2024-12-14 15:55:03,227 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz...
-2024-12-14 15:55:03,232 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:55:03,904 - INFO - Authentication (publickey) successful!
-2024-12-14 15:55:03,925 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:55:08,230 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:55:19,200 - INFO - Skipping Logical Resource Estimate because number of orbitals (74) exceeds maximum specified in config (32).
-2024-12-14 15:55:19,201 - INFO - supporting data file UUID: 6e127086-f92c-4ff5-ab61-7999670be0e7.
-2024-12-14 15:55:19,201 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_c_n_cc-pVTZ.6e127086-f92c-4ff5-ab61-7999670be0e7.chk.
-2024-12-14 15:55:19,201 - INFO - assuming h_c_n_cc-pVTZ.6e127086-f92c-4ff5-ab61-7999670be0e7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:55:19,202 - INFO - parsing ../problem_instances/problem_instance.si_h4_0.13c7144d-047e-4431-8d02-0b1d14c0526b.json
-2024-12-14 15:55:19,203 - INFO - problem_instance UUID: 13c7144d-047e-4431-8d02-0b1d14c0526b
-2024-12-14 15:55:19,203 - INFO - problem_instance short name: si_h4_0
-2024-12-14 15:55:19,203 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:55:19,224 - INFO - Analyzing task 2eaee11d-c1a0-4d2b-b29b-a38e658572f2...
-2024-12-14 15:55:19,225 - INFO - number of supporting files: 2
-2024-12-14 15:55:19,225 - INFO - supporting data file UUID: c37edb04-5163-4d5c-a54e-df5887f0d82e.
-2024-12-14 15:55:19,225 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz.
-2024-12-14 15:55:19,225 - INFO - assuming fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz is an FCIDUMP file.
-2024-12-14 15:55:19,225 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz...
-2024-12-14 15:55:19,232 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:55:19,872 - INFO - Authentication (publickey) successful!
-2024-12-14 15:55:19,889 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:55:20,092 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:55:21,795 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 15:55:21,795 - INFO - supporting data file UUID: de9aba1e-5c4d-4372-8895-d1495c7af8fa.
-2024-12-14 15:55:21,795 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h4_cc-pVDZ.de9aba1e-5c4d-4372-8895-d1495c7af8fa.chk.
-2024-12-14 15:55:21,795 - INFO - assuming si_h4_cc-pVDZ.de9aba1e-5c4d-4372-8895-d1495c7af8fa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:55:21,795 - INFO - Analyzing task 6ca72d49-425b-43f3-96e7-4067bacd0596...
-2024-12-14 15:55:21,795 - INFO - number of supporting files: 2
-2024-12-14 15:55:21,795 - INFO - supporting data file UUID: e709c0b6-d851-47d2-b72a-f4da8479a772.
-2024-12-14 15:55:21,795 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz.
-2024-12-14 15:55:21,796 - INFO - assuming fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz is an FCIDUMP file.
-2024-12-14 15:55:21,796 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz...
-2024-12-14 15:55:21,801 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:55:22,455 - INFO - Authentication (publickey) successful!
-2024-12-14 15:55:22,478 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:57:00,271 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:57:53,165 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 15:57:53,165 - INFO - supporting data file UUID: 10435f0a-a736-4c87-957b-f7a1183b2eca.
-2024-12-14 15:57:53,165 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h4_cc-pVTZ.10435f0a-a736-4c87-957b-f7a1183b2eca.chk.
-2024-12-14 15:57:53,165 - INFO - assuming si_h4_cc-pVTZ.10435f0a-a736-4c87-957b-f7a1183b2eca.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:57:53,167 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0009.8db449b1-265b-4a66-b965-a2b4833a88d1.json
-2024-12-14 15:57:53,167 - INFO - problem_instance UUID: 8db449b1-265b-4a66-b965-a2b4833a88d1
-2024-12-14 15:57:53,167 - INFO - problem_instance short name: planted_solution_0009
-2024-12-14 15:57:53,167 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 15:57:53,183 - INFO - Analyzing task 8f373cb0-952d-48c6-a871-8a10e52e7c19...
-2024-12-14 15:57:53,183 - INFO - number of supporting files: 1
-2024-12-14 15:57:53,183 - INFO - supporting data file UUID: bbbbba1c-868c-45a5-b16c-0c17536e83d8.
-2024-12-14 15:57:53,183 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz.
-2024-12-14 15:57:53,183 - INFO - assuming fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz is an FCIDUMP file.
-2024-12-14 15:57:53,183 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz...
-2024-12-14 15:57:53,188 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:57:53,723 - INFO - Authentication (publickey) successful!
-2024-12-14 15:57:53,740 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:57:56,567 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:58:05,281 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 15:58:05,283 - INFO - parsing ../problem_instances/problem_instance.Mn_1.11c8be98-d9c9-40ea-8d88-ea8c555028f6.json
-2024-12-14 15:58:05,283 - INFO - problem_instance UUID: 11c8be98-d9c9-40ea-8d88-ea8c555028f6
-2024-12-14 15:58:05,283 - INFO - problem_instance short name: Mn_1
-2024-12-14 15:58:05,284 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:58:05,299 - INFO - Analyzing task 9d82f7d4-165d-4499-8add-361a770d1d44...
-2024-12-14 15:58:05,299 - INFO - number of supporting files: 2
-2024-12-14 15:58:05,299 - INFO - supporting data file UUID: 51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.
-2024-12-14 15:58:05,299 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz.
-2024-12-14 15:58:05,299 - INFO - assuming fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz is an FCIDUMP file.
-2024-12-14 15:58:05,299 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz...
-2024-12-14 15:58:05,303 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:58:05,945 - INFO - Authentication (publickey) successful!
-2024-12-14 15:58:05,959 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:58:06,663 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:58:09,107 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 15:58:09,107 - INFO - supporting data file UUID: d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.
-2024-12-14 15:58:09,107 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn1_vdz.d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.chk.
-2024-12-14 15:58:09,107 - INFO - assuming Mn1_vdz.d6ee6ee5-1c48-4d9b-8175-e94f0d3e9924.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:58:09,107 - INFO - Analyzing task 29eecba9-3d4d-4672-8b19-475f53b2f1be...
-2024-12-14 15:58:09,107 - INFO - number of supporting files: 2
-2024-12-14 15:58:09,107 - INFO - supporting data file UUID: 00c757c4-3c99-4521-82b1-3e3a12d49854.
-2024-12-14 15:58:09,107 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz.
-2024-12-14 15:58:09,107 - INFO - assuming fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz is an FCIDUMP file.
-2024-12-14 15:58:09,107 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz...
-2024-12-14 15:58:09,112 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:58:09,730 - INFO - Authentication (publickey) successful!
-2024-12-14 15:58:09,742 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:58:32,968 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:58:59,473 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 15:58:59,473 - INFO - supporting data file UUID: e4481467-4b06-43b0-9e22-b3c5fa930709.
-2024-12-14 15:58:59,473 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Mn1_vtz.e4481467-4b06-43b0-9e22-b3c5fa930709.chk.
-2024-12-14 15:58:59,473 - INFO - assuming Mn1_vtz.e4481467-4b06-43b0-9e22-b3c5fa930709.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:58:59,474 - INFO - parsing ../problem_instances/problem_instance.c_h3_cl_0.379781b8-5732-492e-9fca-6fad3fc3692a.json
-2024-12-14 15:58:59,475 - INFO - problem_instance UUID: 379781b8-5732-492e-9fca-6fad3fc3692a
-2024-12-14 15:58:59,475 - INFO - problem_instance short name: c_h3_cl_0
-2024-12-14 15:58:59,475 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 15:58:59,490 - INFO - Analyzing task 0667179a-19eb-44b9-a544-dae8793fdc3f...
-2024-12-14 15:58:59,490 - INFO - number of supporting files: 2
-2024-12-14 15:58:59,490 - INFO - supporting data file UUID: 80298b55-8915-462f-8f20-e4332c94ed41.
-2024-12-14 15:58:59,490 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz.
-2024-12-14 15:58:59,490 - INFO - assuming fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz is an FCIDUMP file.
-2024-12-14 15:58:59,491 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz...
-2024-12-14 15:58:59,495 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:59:00,162 - INFO - Authentication (publickey) successful!
-2024-12-14 15:59:00,180 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 15:59:00,949 - INFO - [chan 0] sftp session closed.
-2024-12-14 15:59:05,212 - INFO - Skipping Logical Resource Estimate because number of orbitals (47) exceeds maximum specified in config (32).
-2024-12-14 15:59:05,212 - INFO - supporting data file UUID: a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.
-2024-12-14 15:59:05,212 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h3_cl_cc-pVDZ.a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.chk.
-2024-12-14 15:59:05,212 - INFO - assuming c_h3_cl_cc-pVDZ.a522fff7-f228-4ee8-8e52-2b5ab0f4f3ff.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 15:59:05,212 - INFO - Analyzing task ae315bef-f3c6-4c84-93c5-0d8ab510ece3...
-2024-12-14 15:59:05,212 - INFO - number of supporting files: 2
-2024-12-14 15:59:05,212 - INFO - supporting data file UUID: a53ae008-4ad2-4736-9a57-cfc011e3aace.
-2024-12-14 15:59:05,212 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz.
-2024-12-14 15:59:05,212 - INFO - assuming fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz is an FCIDUMP file.
-2024-12-14 15:59:05,213 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz...
-2024-12-14 15:59:05,217 - INFO - Connected (version 2.0, client 0)
-2024-12-14 15:59:05,875 - INFO - Authentication (publickey) successful!
-2024-12-14 15:59:05,891 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:06:08,943 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:07:55,856 - INFO - Skipping Logical Resource Estimate because number of orbitals (106) exceeds maximum specified in config (32).
-2024-12-14 16:07:55,856 - INFO - supporting data file UUID: 17f3e9f1-f59d-4bfd-acbd-f85a3b87cf4a.
-2024-12-14 16:07:55,856 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h3_cl_cc-pVTZ.17f3e9f1-f59d-4bfd-acbd-f85a3b87cf4a.chk.
-2024-12-14 16:07:55,857 - INFO - assuming c_h3_cl_cc-pVTZ.17f3e9f1-f59d-4bfd-acbd-f85a3b87cf4a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:07:55,873 - INFO - parsing ../problem_instances/problem_instance.p2_0.2e61ba35-b6b0-42b5-b3e8-d25bd83145ba.json
-2024-12-14 16:07:55,873 - INFO - problem_instance UUID: 2e61ba35-b6b0-42b5-b3e8-d25bd83145ba
-2024-12-14 16:07:55,873 - INFO - problem_instance short name: p2_0
-2024-12-14 16:07:55,874 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:07:55,889 - INFO - Analyzing task 084acde0-d1c7-4721-aa45-acb4832e0998...
-2024-12-14 16:07:55,889 - INFO - number of supporting files: 2
-2024-12-14 16:07:55,889 - INFO - supporting data file UUID: 7702bafa-2620-4d12-8ec6-e8c6246d385a.
-2024-12-14 16:07:55,889 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a.gz.
-2024-12-14 16:07:55,889 - INFO - assuming fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a.gz is an FCIDUMP file.
-2024-12-14 16:07:55,889 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a.gz...
-2024-12-14 16:07:55,895 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:07:56,548 - INFO - Authentication (publickey) successful!
-2024-12-14 16:07:56,565 - INFO - [chan 0] Opened sftp connection (server version 3)
-Downloading gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz to FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63.gz...
-Parsing FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_12.5439a548-153b-4990-be12-f0e33c30fe63
-Downloading gsee/FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz to FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8.gz...
-Parsing FCIDUMP_d_2.0_b_cc-pvdz-dk_ne_28.e2995852-9911-4021-a82f-5b14ddb2d5c8
-Downloading gsee/FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz to FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272.gz...
-Parsing FCIDUMP_d_3.0_b_sto-3g_ne_12.67acc90d-1a9e-49a7-98a1-8ca643dca272
-Downloading gsee/FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz to FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e.gz...
-Parsing FCIDUMP_d_3.0_b_sto-3g_ne_28.01d526fb-276e-4369-85d4-66a553a1d02e
-Downloading gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz to FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4.gz...
-Parsing FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_12.b0eb2de4-1286-4cfb-8724-e5e4bfc7a4f4
-Downloading gsee/FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz to FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079.gz...
-Parsing FCIDUMP_d_3.0_b_cc-pvdz-dk_ne_28.2101e6fa-9fb3-4697-98be-25a4e0de2079
-Downloading gsee/small_molecules/fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz to fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb.gz...
-Parsing fcidump.be_cc-pVQZ.f9afcdc1-ce5c-40dd-ae18-0afc933da5bb
-Downloading gsee/small_molecules/fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz to fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494.gz...
-Parsing fcidump.be_cc-pVTZ.fdc83bd0-c9bd-47da-abee-99b743b36494
-Downloading gsee/small_molecules/fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz to fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044.gz...
-Parsing fcidump.f2_cc-pVDZ.ac269a87-2bc4-458e-8f4a-64f524c77044
-Downloading gsee/small_molecules/fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz to fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922.gz...
-Parsing fcidump.f2_cc-pVQZ.29d645f8-ce30-4e18-9f41-644ac5f9d922
-Downloading gsee/small_molecules/fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz to fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694.gz...
-Parsing fcidump.f2_cc-pVTZ.3c3967d4-17c1-4947-9465-b9223b01e694
-Downloading gsee/small_molecules/fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz to fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9.gz...
-Parsing fcidump.n2_cc-pVDZ.60c52c22-d27a-4544-8b9c-6022507611f9
-Downloading gsee/small_molecules/fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz to fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4.gz...
-Parsing fcidump.n2_cc-pVQZ.e84ef191-bfe0-4859-96b9-0613cad743d4
-Downloading gsee/small_molecules/fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz to fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887.gz...
-Parsing fcidump.n2_cc-pVTZ.48512c28-04a3-4e3b-b6b2-3e4b654c1887
-Downloading gsee/fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz to fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97.gz...
-Parsing fcidump.50_6acme_0.2_old.79e71b3e-6364-4972-b4b3-07841fa8ba97
-Downloading gsee/fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz to fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2.gz...
-Parsing fcidump.51_6acme_0.2_old.e8f72c80-2fde-4bdc-ac1e-07220942f1c2
-Downloading gsee/fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz to fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0.gz...
-Parsing fcidump.52_6acme_0.2_old.4854c3ff-b3ce-462b-ab8e-0b132cd880d0
-Downloading gsee/fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz to fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f.gz...
-Parsing fcidump.53_ts56_0.2_old.379a0693-4ac3-4ff0-be33-7be3f6cad84f
-Downloading gsee/fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz to fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b.gz...
-Parsing fcidump.54_ts56_0.2_old.22ab7092-61bb-401f-ac43-912ec10ea48b
-Downloading gsee/fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz to fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86.gz...
-Parsing fcidump.55_ts56_0.2_old.8a8780b0-a0ba-4b7e-9847-589302123e86
-Downloading gsee/fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz to fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e.gz...
-Parsing fcidump.56_5_0.2_old.e6671ea9-f0cf-413c-97cb-c8ab6eda9d5e
-Downloading gsee/fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz to fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047.gz...
-Parsing fcidump.57_5_0.2_old.eb34bf5e-ecd6-4c2a-9eb6-d9bcb507e047
-Downloading gsee/fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz to fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3.gz...
-Parsing fcidump.58_5_0.2_old.5f3178b5-0ad3-469a-ae08-e9ecdc637ed3
-Downloading gsee/small_molecules/fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz to fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2.gz...
-Parsing fcidump.Fe1_vdz.b57e3b82-2511-4c00-a850-f6aeba98b0b2
-Downloading gsee/small_molecules/fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz to fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211.gz...
-Parsing fcidump.Fe1_vtz.b9615d62-11ee-49f7-8df4-df94466b2211
-Downloading gsee/small_molecules/fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz to fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2.gz...
-Parsing fcidump.ScO_vdz.987498ce-5b91-4df6-924c-82d4841c17c2
-Downloading gsee/planted_solutions/fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz to fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe.gz...
-Parsing fcidump.planted_solution_0003.efddd28a-383d-4929-9335-22e54ba2ffbe
-Downloading gsee/small_molecules/fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz to fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82.gz...
-Parsing fcidump.h_c_n_cc-pVDZ.8ab023ed-7cdf-49e6-87d9-369a13f2ac82
-Downloading gsee/small_molecules/fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz to fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de.gz...
-Parsing fcidump.h_c_n_cc-pVTZ.6fdfd37c-a5dc-4481-b08e-87dcfec8a4de
-Downloading gsee/small_molecules/fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz to fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e.gz...
-Parsing fcidump.si_h4_cc-pVDZ.c37edb04-5163-4d5c-a54e-df5887f0d82e
-Downloading gsee/small_molecules/fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz to fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772.gz...
-Parsing fcidump.si_h4_cc-pVTZ.e709c0b6-d851-47d2-b72a-f4da8479a772
-Downloading gsee/planted_solutions/fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz to fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8.gz...
-Parsing fcidump.planted_solution_0009.bbbbba1c-868c-45a5-b16c-0c17536e83d8
-Downloading gsee/small_molecules/fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz to fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4.gz...
-Parsing fcidump.Mn1_vdz.51fac1c9-e29a-4033-b3d3-9cc37f64b4d4
-Downloading gsee/small_molecules/fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz to fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854.gz...
-Parsing fcidump.Mn1_vtz.00c757c4-3c99-4521-82b1-3e3a12d49854
-Downloading gsee/small_molecules/fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz to fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41.gz...
-Parsing fcidump.c_h3_cl_cc-pVDZ.80298b55-8915-462f-8f20-e4332c94ed41
-Downloading gsee/small_molecules/fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz to fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace.gz...
-Parsing fcidump.c_h3_cl_cc-pVTZ.a53ae008-4ad2-4736-9a57-cfc011e3aace
-2024-12-14 16:07:56,701 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:07:57,775 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 16:07:57,776 - INFO - supporting data file UUID: f08ade09-d3e1-469c-8d7f-3a6b8734e06e.
-2024-12-14 16:07:57,776 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p2_cc-pVDZ.f08ade09-d3e1-469c-8d7f-3a6b8734e06e.chk.
-2024-12-14 16:07:57,776 - INFO - assuming p2_cc-pVDZ.f08ade09-d3e1-469c-8d7f-3a6b8734e06e.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:07:57,776 - INFO - Analyzing task e61df0de-0a97-4204-9fb9-3995c30d7999...
-2024-12-14 16:07:57,776 - INFO - number of supporting files: 2
-2024-12-14 16:07:57,776 - INFO - supporting data file UUID: 334dbd9d-2c13-4c76-8479-e82280065a02.
-2024-12-14 16:07:57,776 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02.gz.
-2024-12-14 16:07:57,776 - INFO - assuming fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02.gz is an FCIDUMP file.
-2024-12-14 16:07:57,776 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02.gz...
-2024-12-14 16:07:57,782 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:07:58,452 - INFO - Authentication (publickey) successful!
-2024-12-14 16:07:58,470 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:12:30,853 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:13:57,141 - INFO - Skipping Logical Resource Estimate because number of orbitals (118) exceeds maximum specified in config (32).
-2024-12-14 16:13:57,142 - INFO - supporting data file UUID: 92f4f69f-4e8d-4059-af53-86516e671585.
-2024-12-14 16:13:57,142 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p2_cc-pVQZ.92f4f69f-4e8d-4059-af53-86516e671585.chk.
-2024-12-14 16:13:57,142 - INFO - assuming p2_cc-pVQZ.92f4f69f-4e8d-4059-af53-86516e671585.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:13:57,143 - INFO - Analyzing task 23a06c81-be81-4f88-98ab-9e7030c909ef...
-2024-12-14 16:13:57,143 - INFO - number of supporting files: 2
-2024-12-14 16:13:57,143 - INFO - supporting data file UUID: 1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.
-2024-12-14 16:13:57,143 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.gz.
-2024-12-14 16:13:57,143 - INFO - assuming fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.gz is an FCIDUMP file.
-2024-12-14 16:13:57,143 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.gz...
-2024-12-14 16:13:57,155 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:13:57,817 - INFO - Authentication (publickey) successful!
-2024-12-14 16:13:57,837 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:14:03,196 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:14:12,786 - INFO - Skipping Logical Resource Estimate because number of orbitals (68) exceeds maximum specified in config (32).
-2024-12-14 16:14:12,786 - INFO - supporting data file UUID: e7286181-b703-42a7-ad54-2d3a3e741d61.
-2024-12-14 16:14:12,786 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/p2_cc-pVTZ.e7286181-b703-42a7-ad54-2d3a3e741d61.chk.
-2024-12-14 16:14:12,786 - INFO - assuming p2_cc-pVTZ.e7286181-b703-42a7-ad54-2d3a3e741d61.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:14:12,788 - INFO - parsing ../problem_instances/problem_instance.si_o_0.68f1a091-8652-4095-ba31-56f0e02e27d3.json
-2024-12-14 16:14:12,788 - INFO - problem_instance UUID: 68f1a091-8652-4095-ba31-56f0e02e27d3
-2024-12-14 16:14:12,788 - INFO - problem_instance short name: si_o_0
-2024-12-14 16:14:12,788 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:14:12,798 - INFO - Analyzing task 88a6b9fd-e159-4059-9ee5-ba718fd624dc...
-2024-12-14 16:14:12,798 - INFO - number of supporting files: 2
-2024-12-14 16:14:12,798 - INFO - supporting data file UUID: ab244b36-ab52-4cce-b50a-2b04d8c548e7.
-2024-12-14 16:14:12,798 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7.gz.
-2024-12-14 16:14:12,798 - INFO - assuming fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7.gz is an FCIDUMP file.
-2024-12-14 16:14:12,799 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7.gz...
-2024-12-14 16:14:12,805 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:14:13,458 - INFO - Authentication (publickey) successful!
-2024-12-14 16:14:13,476 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:14:13,564 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:14:13,974 - INFO - ===============================================
-2024-12-14 16:14:13,975 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 362 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 369 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 374 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 378 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 381 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 382 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 384 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 385 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 386 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 387 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 388 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 389 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 390 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 391 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 392 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 393 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 394 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 395 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 396 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 397 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 398 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 399 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 400 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 401 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 402 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 403 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 404 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 405 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 406 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 407 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 408 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 409 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 410 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 411 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 412 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 16:17:06,220 - INFO - Circuit initialization time: 172.245378 seconds.
-2024-12-14 16:17:06,220 - INFO - Estimating logical resources...
-2024-12-14 16:17:31,770 - INFO - Resource estimation time (seconds): 25.549363
-2024-12-14 16:17:31,770 - INFO - supporting data file UUID: c2098b79-b369-4b4b-be59-d4e3953debbd.
-2024-12-14 16:17:31,770 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_o_cc-pVDZ.c2098b79-b369-4b4b-be59-d4e3953debbd.chk.
-2024-12-14 16:17:31,770 - INFO - assuming si_o_cc-pVDZ.c2098b79-b369-4b4b-be59-d4e3953debbd.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:17:31,770 - INFO - Analyzing task cca08104-f5f6-407f-9c62-faadc8f29bec...
-2024-12-14 16:17:31,770 - INFO - number of supporting files: 2
-2024-12-14 16:17:31,770 - INFO - supporting data file UUID: 80214e7b-2e1f-440f-b9eb-ee9a16ed8398.
-2024-12-14 16:17:31,770 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398.gz.
-2024-12-14 16:17:31,770 - INFO - assuming fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398.gz is an FCIDUMP file.
-2024-12-14 16:17:31,770 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398.gz...
-2024-12-14 16:17:31,775 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:17:32,419 - INFO - Authentication (publickey) successful!
-2024-12-14 16:17:32,433 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:19:31,605 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:20:32,410 - INFO - Skipping Logical Resource Estimate because number of orbitals (114) exceeds maximum specified in config (32).
-2024-12-14 16:20:32,410 - INFO - supporting data file UUID: 5d33c531-597b-4641-9c65-2369f52972b5.
-2024-12-14 16:20:32,410 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_o_cc-pVQZ.5d33c531-597b-4641-9c65-2369f52972b5.chk.
-2024-12-14 16:20:32,410 - INFO - assuming si_o_cc-pVQZ.5d33c531-597b-4641-9c65-2369f52972b5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:20:32,411 - INFO - Analyzing task 8aa559b0-3aae-4850-a2d7-14e037ce26c0...
-2024-12-14 16:20:32,411 - INFO - number of supporting files: 2
-2024-12-14 16:20:32,411 - INFO - supporting data file UUID: 1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.
-2024-12-14 16:20:32,411 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.gz.
-2024-12-14 16:20:32,411 - INFO - assuming fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.gz is an FCIDUMP file.
-2024-12-14 16:20:32,411 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.gz...
-2024-12-14 16:20:32,416 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:20:33,060 - INFO - Authentication (publickey) successful!
-2024-12-14 16:20:33,074 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:20:34,637 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:20:40,746 - INFO - Skipping Logical Resource Estimate because number of orbitals (64) exceeds maximum specified in config (32).
-2024-12-14 16:20:40,746 - INFO - supporting data file UUID: b37630a8-c0e0-4a2f-950f-b132623cf31c.
-2024-12-14 16:20:40,746 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_o_cc-pVTZ.b37630a8-c0e0-4a2f-950f-b132623cf31c.chk.
-2024-12-14 16:20:40,746 - INFO - assuming si_o_cc-pVTZ.b37630a8-c0e0-4a2f-950f-b132623cf31c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:20:40,748 - INFO - parsing ../problem_instances/problem_instance.h2_o_0.9b8083ab-ea59-47db-894c-95a0d2ba3cb6.json
-2024-12-14 16:20:40,749 - INFO - problem_instance UUID: 9b8083ab-ea59-47db-894c-95a0d2ba3cb6
-2024-12-14 16:20:40,749 - INFO - problem_instance short name: h2_o_0
-2024-12-14 16:20:40,749 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:20:40,764 - INFO - Analyzing task 80d75334-b878-41ec-99a8-b21277f3df60...
-2024-12-14 16:20:40,764 - INFO - number of supporting files: 2
-2024-12-14 16:20:40,764 - INFO - supporting data file UUID: 96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.
-2024-12-14 16:20:40,764 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.gz.
-2024-12-14 16:20:40,764 - INFO - assuming fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.gz is an FCIDUMP file.
-2024-12-14 16:20:40,764 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.gz...
-2024-12-14 16:20:40,770 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:20:41,391 - INFO - Authentication (publickey) successful!
-2024-12-14 16:20:41,405 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:20:41,463 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:20:41,571 - INFO - ===============================================
-2024-12-14 16:20:41,571 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 252 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 254 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 255 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 256 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 257 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 258 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 259 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 260 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 261 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 262 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 263 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 264 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 265 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 266 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 267 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 268 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 269 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 270 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 271 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 272 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 273 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 16:21:32,052 - INFO - Circuit initialization time: 50.48078 seconds.
-2024-12-14 16:21:32,052 - INFO - Estimating logical resources...
-2024-12-14 16:21:44,540 - INFO - Resource estimation time (seconds): 12.488183
-2024-12-14 16:21:44,541 - INFO - supporting data file UUID: 3a9877c5-bdd8-42e6-82de-5017afd0758b.
-2024-12-14 16:21:44,541 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o_cc-pVDZ.3a9877c5-bdd8-42e6-82de-5017afd0758b.chk.
-2024-12-14 16:21:44,541 - INFO - assuming h2_o_cc-pVDZ.3a9877c5-bdd8-42e6-82de-5017afd0758b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:21:44,541 - INFO - Analyzing task 5e576716-0df8-4712-8f03-ea1ac3808e35...
-2024-12-14 16:21:44,541 - INFO - number of supporting files: 2
-2024-12-14 16:21:44,541 - INFO - supporting data file UUID: 26e93a92-0fb0-43bf-9c8d-6b97eb974d27.
-2024-12-14 16:21:44,541 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27.gz.
-2024-12-14 16:21:44,541 - INFO - assuming fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27.gz is an FCIDUMP file.
-2024-12-14 16:21:44,541 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27.gz...
-2024-12-14 16:21:44,546 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:21:45,199 - INFO - Authentication (publickey) successful!
-2024-12-14 16:21:45,216 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:23:08,253 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:23:56,930 - INFO - Skipping Logical Resource Estimate because number of orbitals (115) exceeds maximum specified in config (32).
-2024-12-14 16:23:56,930 - INFO - supporting data file UUID: 0480d761-3895-4b3c-9bea-616160b3c807.
-2024-12-14 16:23:56,930 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o_cc-pVQZ.0480d761-3895-4b3c-9bea-616160b3c807.chk.
-2024-12-14 16:23:56,930 - INFO - assuming h2_o_cc-pVQZ.0480d761-3895-4b3c-9bea-616160b3c807.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:23:56,931 - INFO - Analyzing task 4e395cc5-b5d2-4b82-95a2-1276262386c8...
-2024-12-14 16:23:56,931 - INFO - number of supporting files: 2
-2024-12-14 16:23:56,931 - INFO - supporting data file UUID: dd869557-00f9-421f-ab39-faa9d8e05df2.
-2024-12-14 16:23:56,931 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2.gz.
-2024-12-14 16:23:56,931 - INFO - assuming fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2.gz is an FCIDUMP file.
-2024-12-14 16:23:56,931 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2.gz...
-2024-12-14 16:23:56,936 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:23:57,565 - INFO - Authentication (publickey) successful!
-2024-12-14 16:23:57,582 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:23:58,163 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:01,619 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 16:24:01,619 - INFO - supporting data file UUID: 8d8f097e-dd3e-48ed-8cb8-204760a8cfa4.
-2024-12-14 16:24:01,619 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o_cc-pVTZ.8d8f097e-dd3e-48ed-8cb8-204760a8cfa4.chk.
-2024-12-14 16:24:01,619 - INFO - assuming h2_o_cc-pVTZ.8d8f097e-dd3e-48ed-8cb8-204760a8cfa4.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:24:01,621 - INFO - parsing ../problem_instances/problem_instance.h_o_cl_0.ea2e13c5-6d80-466e-bd6b-6289e10ed82b.json
-2024-12-14 16:24:01,622 - INFO - problem_instance UUID: ea2e13c5-6d80-466e-bd6b-6289e10ed82b
-2024-12-14 16:24:01,622 - INFO - problem_instance short name: h_o_cl_0
-2024-12-14 16:24:01,622 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:24:01,637 - INFO - Analyzing task bd44e482-057d-42c3-a052-cbd952fa8025...
-2024-12-14 16:24:01,637 - INFO - number of supporting files: 2
-2024-12-14 16:24:01,637 - INFO - supporting data file UUID: 95dec49b-7d4e-4889-9e31-97e21db7b329.
-2024-12-14 16:24:01,637 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329.gz.
-2024-12-14 16:24:01,637 - INFO - assuming fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329.gz is an FCIDUMP file.
-2024-12-14 16:24:01,637 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329.gz...
-2024-12-14 16:24:01,642 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:24:02,302 - INFO - Authentication (publickey) successful!
-2024-12-14 16:24:02,320 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:24:02,554 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:03,833 - INFO - Skipping Logical Resource Estimate because number of orbitals (37) exceeds maximum specified in config (32).
-2024-12-14 16:24:03,833 - INFO - supporting data file UUID: aa593c42-1dff-4302-b3f6-85eb6945f108.
-2024-12-14 16:24:03,833 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_o_cl_cc-pVDZ.aa593c42-1dff-4302-b3f6-85eb6945f108.chk.
-2024-12-14 16:24:03,833 - INFO - assuming h_o_cl_cc-pVDZ.aa593c42-1dff-4302-b3f6-85eb6945f108.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:24:03,833 - INFO - Analyzing task fea4b4a2-64a1-45c3-a760-83aec702bdca...
-2024-12-14 16:24:03,833 - INFO - number of supporting files: 2
-2024-12-14 16:24:03,834 - INFO - supporting data file UUID: e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.
-2024-12-14 16:24:03,834 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.gz.
-2024-12-14 16:24:03,834 - INFO - assuming fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.gz is an FCIDUMP file.
-2024-12-14 16:24:03,834 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.gz...
-2024-12-14 16:24:03,838 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:24:04,566 - INFO - Authentication (publickey) successful!
-2024-12-14 16:24:04,584 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:24:17,736 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:36,636 - INFO - Skipping Logical Resource Estimate because number of orbitals (78) exceeds maximum specified in config (32).
-2024-12-14 16:24:36,636 - INFO - supporting data file UUID: 3f652fb4-0324-46c1-ae9a-d69ed4da1756.
-2024-12-14 16:24:36,636 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_o_cl_cc-pVTZ.3f652fb4-0324-46c1-ae9a-d69ed4da1756.chk.
-2024-12-14 16:24:36,636 - INFO - assuming h_o_cl_cc-pVTZ.3f652fb4-0324-46c1-ae9a-d69ed4da1756.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:24:36,638 - INFO - parsing ../problem_instances/problem_instance.c2_h6_0.b1c5ac4e-9b94-4e89-9557-da2026933172.json
-2024-12-14 16:24:36,638 - INFO - problem_instance UUID: b1c5ac4e-9b94-4e89-9557-da2026933172
-2024-12-14 16:24:36,638 - INFO - problem_instance short name: c2_h6_0
-2024-12-14 16:24:36,638 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:24:36,654 - INFO - Analyzing task 15a25e30-cba9-4f63-80a6-ef95a8c79d41...
-2024-12-14 16:24:36,654 - INFO - number of supporting files: 2
-2024-12-14 16:24:36,654 - INFO - supporting data file UUID: da21513f-c490-45e2-8ce9-1c7a511ca925.
-2024-12-14 16:24:36,654 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925.gz.
-2024-12-14 16:24:36,654 - INFO - assuming fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925.gz is an FCIDUMP file.
-2024-12-14 16:24:36,654 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925.gz...
-2024-12-14 16:24:36,659 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:24:37,170 - INFO - Authentication (publickey) successful!
-2024-12-14 16:24:37,183 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:24:40,480 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:47,686 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 16:24:47,686 - INFO - supporting data file UUID: 3f2b2cd3-e675-403f-bea0-92e5f2a909aa.
-2024-12-14 16:24:47,686 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c2_h6_cc-pVDZ.3f2b2cd3-e675-403f-bea0-92e5f2a909aa.chk.
-2024-12-14 16:24:47,686 - INFO - assuming c2_h6_cc-pVDZ.3f2b2cd3-e675-403f-bea0-92e5f2a909aa.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:24:47,688 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0001.3d3b9e8a-7842-4ca1-bd82-eddb9804972d.json
-2024-12-14 16:24:47,722 - INFO - problem_instance UUID: 3d3b9e8a-7842-4ca1-bd82-eddb9804972d
-2024-12-14 16:24:47,722 - INFO - problem_instance short name: planted_solution_0001
-2024-12-14 16:24:47,722 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:24:47,738 - INFO - Analyzing task be3812d3-5975-4736-8a23-96d64e50e66a...
-2024-12-14 16:24:47,738 - INFO - number of supporting files: 1
-2024-12-14 16:24:47,738 - INFO - supporting data file UUID: 3add17d8-cb86-4ae5-8474-96d272269d80.
-2024-12-14 16:24:47,738 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80.gz.
-2024-12-14 16:24:47,738 - INFO - assuming fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80.gz is an FCIDUMP file.
-2024-12-14 16:24:47,738 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80.gz...
-2024-12-14 16:24:47,743 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:24:48,391 - INFO - Authentication (publickey) successful!
-2024-12-14 16:24:48,408 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:24:48,473 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:24:48,491 - INFO - ===============================================
-2024-12-14 16:24:48,491 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 33 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 16:24:57,909 - INFO - Circuit initialization time: 9.417916 seconds.
-2024-12-14 16:24:57,909 - INFO - Estimating logical resources...
-2024-12-14 16:24:59,435 - INFO - Resource estimation time (seconds): 1.525978
-2024-12-14 16:24:59,437 - INFO - parsing ../problem_instances/problem_instance.c_h4_0.e0f6ed02-6502-454b-bf2c-e7994e0510f4.json
-2024-12-14 16:24:59,437 - INFO - problem_instance UUID: e0f6ed02-6502-454b-bf2c-e7994e0510f4
-2024-12-14 16:24:59,437 - INFO - problem_instance short name: c_h4_0
-2024-12-14 16:24:59,437 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:24:59,453 - INFO - Analyzing task 443371ce-c80d-450d-b281-ac1c4d5ecc4d...
-2024-12-14 16:24:59,453 - INFO - number of supporting files: 2
-2024-12-14 16:24:59,453 - INFO - supporting data file UUID: a7321b5d-4730-4ace-9ff8-734ec07f3fef.
-2024-12-14 16:24:59,453 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef.gz.
-2024-12-14 16:24:59,453 - INFO - assuming fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef.gz is an FCIDUMP file.
-2024-12-14 16:24:59,453 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef.gz...
-2024-12-14 16:24:59,458 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:25:00,109 - INFO - Authentication (publickey) successful!
-2024-12-14 16:25:00,127 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:25:00,325 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:25:01,405 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 16:25:01,405 - INFO - supporting data file UUID: 02b1e2b3-66f7-4004-9f27-94d407ab51e1.
-2024-12-14 16:25:01,405 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h4_cc-pVDZ.02b1e2b3-66f7-4004-9f27-94d407ab51e1.chk.
-2024-12-14 16:25:01,405 - INFO - assuming c_h4_cc-pVDZ.02b1e2b3-66f7-4004-9f27-94d407ab51e1.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:25:01,405 - INFO - Analyzing task f936469c-1d1e-4295-a006-84a778c1714c...
-2024-12-14 16:25:01,406 - INFO - number of supporting files: 2
-2024-12-14 16:25:01,406 - INFO - supporting data file UUID: 47a5eadf-e31e-4c38-983f-8c75460463ea.
-2024-12-14 16:25:01,406 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea.gz.
-2024-12-14 16:25:01,406 - INFO - assuming fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea.gz is an FCIDUMP file.
-2024-12-14 16:25:01,406 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea.gz...
-2024-12-14 16:25:01,411 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:25:02,074 - INFO - Authentication (publickey) successful!
-2024-12-14 16:25:02,091 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:26:08,429 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:26:51,026 - INFO - Skipping Logical Resource Estimate because number of orbitals (86) exceeds maximum specified in config (32).
-2024-12-14 16:26:51,026 - INFO - supporting data file UUID: 6e2fb98f-f4d8-47c9-a4f4-496999541f0d.
-2024-12-14 16:26:51,026 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h4_cc-pVTZ.6e2fb98f-f4d8-47c9-a4f4-496999541f0d.chk.
-2024-12-14 16:26:51,026 - INFO - assuming c_h4_cc-pVTZ.6e2fb98f-f4d8-47c9-a4f4-496999541f0d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:26:51,038 - INFO - parsing ../problem_instances/problem_instance.V_1.18e1973e-d6cf-48d6-9ca4-c1af21ff7c98.json
-2024-12-14 16:26:51,038 - INFO - problem_instance UUID: 18e1973e-d6cf-48d6-9ca4-c1af21ff7c98
-2024-12-14 16:26:51,038 - INFO - problem_instance short name: V_1
-2024-12-14 16:26:51,038 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:26:51,055 - INFO - Analyzing task 6d0f8edd-507f-43d5-9960-9ad49532ee42...
-2024-12-14 16:26:51,055 - INFO - number of supporting files: 2
-2024-12-14 16:26:51,055 - INFO - supporting data file UUID: cf7aa422-2b82-4d7c-a031-8923e1fc8a41.
-2024-12-14 16:26:51,055 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41.gz.
-2024-12-14 16:26:51,055 - INFO - assuming fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41.gz is an FCIDUMP file.
-2024-12-14 16:26:51,055 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41.gz...
-2024-12-14 16:26:51,059 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:26:51,710 - INFO - Authentication (publickey) successful!
-2024-12-14 16:26:51,726 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:26:52,322 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:26:55,723 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 16:26:55,724 - INFO - supporting data file UUID: 722f4d71-266b-4bb3-b4fb-d8f9c54ad9d9.
-2024-12-14 16:26:55,724 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/V1_vdz.722f4d71-266b-4bb3-b4fb-d8f9c54ad9d9.chk.
-2024-12-14 16:26:55,724 - INFO - assuming V1_vdz.722f4d71-266b-4bb3-b4fb-d8f9c54ad9d9.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:26:55,724 - INFO - Skipping task 106deaf8-422f-4e06-bf25-6191abd6eecf because no overlap was provided.
-2024-12-14 16:26:55,725 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0007.3aaf0bb4-b412-4746-922a-c380b4024d00.json
-2024-12-14 16:26:55,727 - INFO - problem_instance UUID: 3aaf0bb4-b412-4746-922a-c380b4024d00
-2024-12-14 16:26:55,727 - INFO - problem_instance short name: planted_solution_0007
-2024-12-14 16:26:55,727 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:26:55,742 - INFO - Analyzing task d3c058ec-9b13-4a9a-aba0-d3f19091c47b...
-2024-12-14 16:26:55,742 - INFO - number of supporting files: 1
-2024-12-14 16:26:55,742 - INFO - supporting data file UUID: c594d63e-29c7-462a-b385-f70c6d7d8350.
-2024-12-14 16:26:55,742 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350.gz.
-2024-12-14 16:26:55,742 - INFO - assuming fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350.gz is an FCIDUMP file.
-2024-12-14 16:26:55,742 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350.gz...
-2024-12-14 16:26:55,749 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:26:56,390 - INFO - Authentication (publickey) successful!
-2024-12-14 16:26:56,408 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:26:56,495 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:26:56,854 - INFO - ===============================================
-2024-12-14 16:26:56,854 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 90 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 93 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 94 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 96 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 97 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 98 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 99 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 100 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 101 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 102 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 103 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 16:30:14,565 - INFO - Circuit initialization time: 197.711069 seconds.
-2024-12-14 16:30:14,565 - INFO - Estimating logical resources...
-2024-12-14 16:30:20,795 - INFO - Resource estimation time (seconds): 6.229755
-2024-12-14 16:30:20,797 - INFO - parsing ../problem_instances/problem_instance.Ti_0.c1e4c7dd-2dc4-4dd0-889d-fb34f602965a.json
-2024-12-14 16:30:20,797 - INFO - problem_instance UUID: c1e4c7dd-2dc4-4dd0-889d-fb34f602965a
-2024-12-14 16:30:20,797 - INFO - problem_instance short name: Ti_0
-2024-12-14 16:30:20,797 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:30:20,813 - INFO - Analyzing task ab61c91a-68ea-401f-a3ad-392e83ee802e...
-2024-12-14 16:30:20,813 - INFO - number of supporting files: 2
-2024-12-14 16:30:20,813 - INFO - supporting data file UUID: cdae3a0c-d613-4375-ab65-7088244b54ef.
-2024-12-14 16:30:20,813 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef.gz.
-2024-12-14 16:30:20,813 - INFO - assuming fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef.gz is an FCIDUMP file.
-2024-12-14 16:30:20,813 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef.gz...
-2024-12-14 16:30:20,820 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:30:21,477 - INFO - Authentication (publickey) successful!
-2024-12-14 16:30:21,492 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:30:22,558 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:30:27,465 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 16:30:27,465 - INFO - supporting data file UUID: 83c3df6f-5621-477f-8fad-7bddcb60c363.
-2024-12-14 16:30:27,465 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti0_vdz.83c3df6f-5621-477f-8fad-7bddcb60c363.chk.
-2024-12-14 16:30:27,465 - INFO - assuming Ti0_vdz.83c3df6f-5621-477f-8fad-7bddcb60c363.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:30:27,466 - INFO - Analyzing task 0c023ffe-8453-4f5f-b29e-7863589fb191...
-2024-12-14 16:30:27,466 - INFO - number of supporting files: 2
-2024-12-14 16:30:27,466 - INFO - supporting data file UUID: 7766bf7c-05db-4294-b125-6f0110aa9407.
-2024-12-14 16:30:27,466 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407.gz.
-2024-12-14 16:30:27,466 - INFO - assuming fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407.gz is an FCIDUMP file.
-2024-12-14 16:30:27,466 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407.gz...
-2024-12-14 16:30:27,472 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:30:28,129 - INFO - Authentication (publickey) successful!
-2024-12-14 16:30:28,144 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:30:57,943 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:31:26,868 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 16:31:26,868 - INFO - supporting data file UUID: 0eb3da83-59f1-46f9-9704-11784014a6c2.
-2024-12-14 16:31:26,868 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Ti0_vtz.0eb3da83-59f1-46f9-9704-11784014a6c2.chk.
-2024-12-14 16:31:26,868 - INFO - assuming Ti0_vtz.0eb3da83-59f1-46f9-9704-11784014a6c2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:31:26,873 - INFO - parsing ../problem_instances/problem_instance.CrO_0.2140edd4-8eb3-4270-b753-278334998e3d.json
-2024-12-14 16:31:26,874 - INFO - problem_instance UUID: 2140edd4-8eb3-4270-b753-278334998e3d
-2024-12-14 16:31:26,874 - INFO - problem_instance short name: CrO_0
-2024-12-14 16:31:26,874 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:31:26,890 - INFO - Analyzing task e0101b06-dfd6-4caa-8580-a9815b225204...
-2024-12-14 16:31:26,890 - INFO - number of supporting files: 2
-2024-12-14 16:31:26,890 - INFO - supporting data file UUID: b9a18106-c719-4d0c-af12-30ded772eb55.
-2024-12-14 16:31:26,890 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55.gz.
-2024-12-14 16:31:26,890 - INFO - assuming fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55.gz is an FCIDUMP file.
-2024-12-14 16:31:26,890 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55.gz...
-2024-12-14 16:31:26,896 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:31:27,548 - INFO - Authentication (publickey) successful!
-2024-12-14 16:31:27,563 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:31:32,165 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:31:43,098 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 16:31:43,098 - INFO - supporting data file UUID: 59764ee7-250e-4e06-89c7-e9cdc5850196.
-2024-12-14 16:31:43,098 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/CrO_vdz.59764ee7-250e-4e06-89c7-e9cdc5850196.chk.
-2024-12-14 16:31:43,098 - INFO - assuming CrO_vdz.59764ee7-250e-4e06-89c7-e9cdc5850196.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:31:43,100 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0002.00043d56-ed63-4266-907c-99c95c51b9db.json
-2024-12-14 16:31:43,101 - INFO - problem_instance UUID: 00043d56-ed63-4266-907c-99c95c51b9db
-2024-12-14 16:31:43,102 - INFO - problem_instance short name: planted_solution_0002
-2024-12-14 16:31:43,102 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 16:31:43,117 - INFO - Analyzing task 0deae366-42de-4081-914d-db85c6b47168...
-2024-12-14 16:31:43,117 - INFO - number of supporting files: 1
-2024-12-14 16:31:43,117 - INFO - supporting data file UUID: 16f9288f-be7e-4f8a-ab09-0153263f83c7.
-2024-12-14 16:31:43,117 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7.gz.
-2024-12-14 16:31:43,117 - INFO - assuming fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7.gz is an FCIDUMP file.
-2024-12-14 16:31:43,117 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7.gz...
-2024-12-14 16:31:43,122 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:31:43,742 - INFO - Authentication (publickey) successful!
-2024-12-14 16:31:43,758 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:31:46,875 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:31:55,639 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 16:31:55,640 - INFO - parsing ../problem_instances/problem_instance.h3_c_o_h_0.5524b5e5-adba-4322-9808-69e75e4335b2.json
-2024-12-14 16:31:55,641 - INFO - problem_instance UUID: 5524b5e5-adba-4322-9808-69e75e4335b2
-2024-12-14 16:31:55,641 - INFO - problem_instance short name: h3_c_o_h_0
-2024-12-14 16:31:55,641 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:31:55,656 - INFO - Analyzing task fc3586af-0290-4a4a-81e1-422a1d331a09...
-2024-12-14 16:31:55,656 - INFO - number of supporting files: 2
-2024-12-14 16:31:55,656 - INFO - supporting data file UUID: 26a32758-4c43-4add-a12e-7273b2ddfd0e.
-2024-12-14 16:31:55,656 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e.gz.
-2024-12-14 16:31:55,656 - INFO - assuming fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e.gz is an FCIDUMP file.
-2024-12-14 16:31:55,657 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e.gz...
-2024-12-14 16:31:55,662 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:31:56,320 - INFO - Authentication (publickey) successful!
-2024-12-14 16:31:56,337 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:31:56,777 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:31:59,396 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 16:31:59,397 - INFO - supporting data file UUID: fc9dd1d9-c83f-42c3-ac64-9d4b9d76800a.
-2024-12-14 16:31:59,397 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h3_c_o_h_cc-pVDZ.fc9dd1d9-c83f-42c3-ac64-9d4b9d76800a.chk.
-2024-12-14 16:31:59,397 - INFO - assuming h3_c_o_h_cc-pVDZ.fc9dd1d9-c83f-42c3-ac64-9d4b9d76800a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:31:59,397 - INFO - Analyzing task 7ecc9a42-2b18-4179-81ec-583598fa579b...
-2024-12-14 16:31:59,397 - INFO - number of supporting files: 2
-2024-12-14 16:31:59,397 - INFO - supporting data file UUID: 5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.
-2024-12-14 16:31:59,397 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.gz.
-2024-12-14 16:31:59,397 - INFO - assuming fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.gz is an FCIDUMP file.
-2024-12-14 16:31:59,397 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.gz...
-2024-12-14 16:31:59,403 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:32:00,044 - INFO - Authentication (publickey) successful!
-2024-12-14 16:32:00,061 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:36:01,658 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:37:25,163 - INFO - Skipping Logical Resource Estimate because number of orbitals (116) exceeds maximum specified in config (32).
-2024-12-14 16:37:25,164 - INFO - supporting data file UUID: 05a6c52b-f0b3-440a-9954-75e0df02795a.
-2024-12-14 16:37:25,164 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h3_c_o_h_cc-pVTZ.05a6c52b-f0b3-440a-9954-75e0df02795a.chk.
-2024-12-14 16:37:25,164 - INFO - assuming h3_c_o_h_cc-pVTZ.05a6c52b-f0b3-440a-9954-75e0df02795a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:37:25,179 - INFO - parsing ../problem_instances/problem_instance.Cr_0.b8fe08a4-82fe-4636-9812-b1e0666f95b5.json
-2024-12-14 16:37:25,179 - INFO - problem_instance UUID: b8fe08a4-82fe-4636-9812-b1e0666f95b5
-2024-12-14 16:37:25,179 - INFO - problem_instance short name: Cr_0
-2024-12-14 16:37:25,179 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:37:25,195 - INFO - Analyzing task 5d85532e-9116-48a1-9810-7925c9ed9c57...
-2024-12-14 16:37:25,195 - INFO - number of supporting files: 2
-2024-12-14 16:37:25,195 - INFO - supporting data file UUID: be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.
-2024-12-14 16:37:25,195 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.gz.
-2024-12-14 16:37:25,195 - INFO - assuming fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.gz is an FCIDUMP file.
-2024-12-14 16:37:25,195 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.gz...
-2024-12-14 16:37:25,200 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:37:25,832 - INFO - Authentication (publickey) successful!
-2024-12-14 16:37:25,850 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:37:28,282 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:37:35,581 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 16:37:35,581 - INFO - supporting data file UUID: 40f36526-3534-4688-8bd5-9cb9e1a8a6c8.
-2024-12-14 16:37:35,581 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr0_vdz.40f36526-3534-4688-8bd5-9cb9e1a8a6c8.chk.
-2024-12-14 16:37:35,581 - INFO - assuming Cr0_vdz.40f36526-3534-4688-8bd5-9cb9e1a8a6c8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:37:35,581 - INFO - Analyzing task 35b59fd4-e046-4d69-ba52-4b94a7777ac3...
-2024-12-14 16:37:35,581 - INFO - number of supporting files: 2
-2024-12-14 16:37:35,581 - INFO - supporting data file UUID: dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.
-2024-12-14 16:37:35,582 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.gz.
-2024-12-14 16:37:35,582 - INFO - assuming fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.gz is an FCIDUMP file.
-2024-12-14 16:37:35,582 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.gz...
-2024-12-14 16:37:35,587 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:37:36,225 - INFO - Authentication (publickey) successful!
-2024-12-14 16:37:36,241 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:39:05,044 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:39:56,126 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 16:39:56,126 - INFO - supporting data file UUID: 83f5e74f-7848-4b7d-8c79-85ff5e3ecd8a.
-2024-12-14 16:39:56,127 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Cr0_vtz.83f5e74f-7848-4b7d-8c79-85ff5e3ecd8a.chk.
-2024-12-14 16:39:56,127 - INFO - assuming Cr0_vtz.83f5e74f-7848-4b7d-8c79-85ff5e3ecd8a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:39:56,132 - INFO - parsing ../problem_instances/problem_instance.h2_o2_0.cc7044d7-28e0-4fe2-bd6b-c9c758da4776.json
-2024-12-14 16:39:56,132 - INFO - problem_instance UUID: cc7044d7-28e0-4fe2-bd6b-c9c758da4776
-2024-12-14 16:39:56,132 - INFO - problem_instance short name: h2_o2_0
-2024-12-14 16:39:56,132 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:39:56,148 - INFO - Analyzing task 85743547-31ba-48ff-b854-220e4b9b620f...
-2024-12-14 16:39:56,148 - INFO - number of supporting files: 2
-2024-12-14 16:39:56,148 - INFO - supporting data file UUID: 459b2739-8810-4cd9-82c4-4285c36a0193.
-2024-12-14 16:39:56,148 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193.gz.
-2024-12-14 16:39:56,148 - INFO - assuming fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193.gz is an FCIDUMP file.
-2024-12-14 16:39:56,148 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193.gz...
-2024-12-14 16:39:56,156 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:39:56,807 - INFO - Authentication (publickey) successful!
-2024-12-14 16:39:56,825 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:39:57,066 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:39:58,916 - INFO - Skipping Logical Resource Estimate because number of orbitals (38) exceeds maximum specified in config (32).
-2024-12-14 16:39:58,916 - INFO - supporting data file UUID: ba9db214-256b-4302-9fc3-53c07a2a38f7.
-2024-12-14 16:39:58,916 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o2_cc-pVDZ.ba9db214-256b-4302-9fc3-53c07a2a38f7.chk.
-2024-12-14 16:39:58,916 - INFO - assuming h2_o2_cc-pVDZ.ba9db214-256b-4302-9fc3-53c07a2a38f7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:39:58,916 - INFO - Analyzing task ae328238-7f54-43e2-bf9a-01c60563e578...
-2024-12-14 16:39:58,916 - INFO - number of supporting files: 2
-2024-12-14 16:39:58,916 - INFO - supporting data file UUID: 1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.
-2024-12-14 16:39:58,916 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.gz.
-2024-12-14 16:39:58,916 - INFO - assuming fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.gz is an FCIDUMP file.
-2024-12-14 16:39:58,916 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.gz...
-2024-12-14 16:39:58,921 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:39:59,578 - INFO - Authentication (publickey) successful!
-2024-12-14 16:39:59,593 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:41:32,360 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:42:24,306 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 16:42:24,306 - INFO - supporting data file UUID: a269bb23-789a-4e5d-95fb-79e799b7b57d.
-2024-12-14 16:42:24,306 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h2_o2_cc-pVTZ.a269bb23-789a-4e5d-95fb-79e799b7b57d.chk.
-2024-12-14 16:42:24,306 - INFO - assuming h2_o2_cc-pVTZ.a269bb23-789a-4e5d-95fb-79e799b7b57d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:42:24,312 - INFO - parsing ../problem_instances/problem_instance.c_o_0.1c3155e0-3679-4eff-bed0-57a1082672c3.json
-2024-12-14 16:42:24,312 - INFO - problem_instance UUID: 1c3155e0-3679-4eff-bed0-57a1082672c3
-2024-12-14 16:42:24,312 - INFO - problem_instance short name: c_o_0
-2024-12-14 16:42:24,312 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:42:24,327 - INFO - Analyzing task 02588640-a5ae-48e6-b28b-f6759886ab70...
-2024-12-14 16:42:24,327 - INFO - number of supporting files: 2
-2024-12-14 16:42:24,327 - INFO - supporting data file UUID: 5de3dbbd-1d79-45c9-ac75-4140ae123baa.
-2024-12-14 16:42:24,328 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa.gz.
-2024-12-14 16:42:24,328 - INFO - assuming fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa.gz is an FCIDUMP file.
-2024-12-14 16:42:24,328 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa.gz...
-2024-12-14 16:42:24,334 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:42:25,015 - INFO - Authentication (publickey) successful!
-2024-12-14 16:42:25,031 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:42:25,111 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:42:25,358 - INFO - ===============================================
-2024-12-14 16:42:25,358 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 269 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 282 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 288 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 293 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 295 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 296 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 297 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 299 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 301 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 302 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 303 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 304 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 305 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 306 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 307 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 308 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 309 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 310 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 311 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 312 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 313 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 314 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 320 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 321 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 322 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 16:43:56,812 - INFO - Circuit initialization time: 91.454278 seconds.
-2024-12-14 16:43:56,813 - INFO - Estimating logical resources...
-2024-12-14 16:44:10,570 - INFO - Resource estimation time (seconds): 13.757683
-2024-12-14 16:44:10,571 - INFO - supporting data file UUID: b9b25ab0-9049-423b-b5e4-c2cb73ae60e8.
-2024-12-14 16:44:10,571 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o_cc-pVDZ.b9b25ab0-9049-423b-b5e4-c2cb73ae60e8.chk.
-2024-12-14 16:44:10,571 - INFO - assuming c_o_cc-pVDZ.b9b25ab0-9049-423b-b5e4-c2cb73ae60e8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:44:10,571 - INFO - Analyzing task 7ea61c79-c0e5-453b-8fd0-b176cb8821a7...
-2024-12-14 16:44:10,571 - INFO - number of supporting files: 2
-2024-12-14 16:44:10,571 - INFO - supporting data file UUID: 0c547725-1536-47b8-98f9-ed1384ceb939.
-2024-12-14 16:44:10,571 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939.gz.
-2024-12-14 16:44:10,571 - INFO - assuming fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939.gz is an FCIDUMP file.
-2024-12-14 16:44:10,571 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939.gz...
-2024-12-14 16:44:10,576 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:44:11,242 - INFO - Authentication (publickey) successful!
-2024-12-14 16:44:11,258 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:45:27,396 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:46:17,422 - INFO - Skipping Logical Resource Estimate because number of orbitals (110) exceeds maximum specified in config (32).
-2024-12-14 16:46:17,422 - INFO - supporting data file UUID: 4e162895-4ecb-4b39-80c8-f3b2327c3ca7.
-2024-12-14 16:46:17,422 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o_cc-pVQZ.4e162895-4ecb-4b39-80c8-f3b2327c3ca7.chk.
-2024-12-14 16:46:17,422 - INFO - assuming c_o_cc-pVQZ.4e162895-4ecb-4b39-80c8-f3b2327c3ca7.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:46:17,422 - INFO - Analyzing task a92f6594-5ccc-4385-9cb5-8c21b4407dcf...
-2024-12-14 16:46:17,422 - INFO - number of supporting files: 2
-2024-12-14 16:46:17,422 - INFO - supporting data file UUID: 2b749f51-9ea9-41c4-9f67-e9c8334478c4.
-2024-12-14 16:46:17,422 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4.gz.
-2024-12-14 16:46:17,422 - INFO - assuming fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4.gz is an FCIDUMP file.
-2024-12-14 16:46:17,422 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4.gz...
-2024-12-14 16:46:17,427 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:46:18,102 - INFO - Authentication (publickey) successful!
-2024-12-14 16:46:18,119 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:46:19,449 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:46:24,139 - INFO - Skipping Logical Resource Estimate because number of orbitals (60) exceeds maximum specified in config (32).
-2024-12-14 16:46:24,139 - INFO - supporting data file UUID: 362780fa-e430-4477-abe0-cef3e01f4bc8.
-2024-12-14 16:46:24,139 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o_cc-pVTZ.362780fa-e430-4477-abe0-cef3e01f4bc8.chk.
-2024-12-14 16:46:24,139 - INFO - assuming c_o_cc-pVTZ.362780fa-e430-4477-abe0-cef3e01f4bc8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:46:24,141 - INFO - parsing ../problem_instances/problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
-2024-12-14 16:46:24,141 - INFO - problem_instance UUID: c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7
-2024-12-14 16:46:24,141 - INFO - problem_instance short name: Sc_1
-2024-12-14 16:46:24,142 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:46:24,156 - INFO - Analyzing task ca6f7678-0952-4fe4-83fe-c4455a682132...
-2024-12-14 16:46:24,157 - INFO - number of supporting files: 2
-2024-12-14 16:46:24,157 - INFO - supporting data file UUID: 75228927-fac3-4caf-9e09-1fdfe51098a3.
-2024-12-14 16:46:24,157 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz.
-2024-12-14 16:46:24,157 - INFO - assuming fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz is an FCIDUMP file.
-2024-12-14 16:46:24,157 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz...
-2024-12-14 16:46:24,163 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:46:24,815 - INFO - Authentication (publickey) successful!
-2024-12-14 16:46:24,833 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:46:25,042 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:46:26,958 - INFO - Skipping Logical Resource Estimate because number of orbitals (54) exceeds maximum specified in config (32).
-2024-12-14 16:46:26,959 - INFO - supporting data file UUID: 5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.
-2024-12-14 16:46:26,959 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk.
-2024-12-14 16:46:26,959 - INFO - assuming Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:46:26,959 - INFO - Analyzing task 10119019-eea2-45c9-a748-e206780c4235...
-2024-12-14 16:46:26,959 - INFO - number of supporting files: 2
-2024-12-14 16:46:26,959 - INFO - supporting data file UUID: cfc29172-5c9c-4e13-9a31-17895ed89c95.
-2024-12-14 16:46:26,959 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz.
-2024-12-14 16:46:26,959 - INFO - assuming fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz is an FCIDUMP file.
-2024-12-14 16:46:26,959 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz...
-2024-12-14 16:46:26,964 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:46:27,618 - INFO - Authentication (publickey) successful!
-2024-12-14 16:46:27,634 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:49:07,251 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:50:15,176 - INFO - Skipping Logical Resource Estimate because number of orbitals (135) exceeds maximum specified in config (32).
-2024-12-14 16:50:15,176 - INFO - supporting data file UUID: 49ba78c1-9c90-45ed-afe8-56cf76b89697.
-2024-12-14 16:50:15,176 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vqz.49ba78c1-9c90-45ed-afe8-56cf76b89697.chk.
-2024-12-14 16:50:15,176 - INFO - assuming Sc1_vqz.49ba78c1-9c90-45ed-afe8-56cf76b89697.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:50:15,176 - INFO - Analyzing task 78d5e5ba-0b2c-4cfe-92c5-f1c749150015...
-2024-12-14 16:50:15,176 - INFO - number of supporting files: 2
-2024-12-14 16:50:15,176 - INFO - supporting data file UUID: adfdddd9-6ebe-4661-8bd8-c8810f117a6a.
-2024-12-14 16:50:15,176 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz.
-2024-12-14 16:50:15,176 - INFO - assuming fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz is an FCIDUMP file.
-2024-12-14 16:50:15,177 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz...
-2024-12-14 16:50:15,181 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:50:15,838 - INFO - Authentication (publickey) successful!
-2024-12-14 16:50:15,851 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:50:23,524 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:50:35,717 - INFO - Skipping Logical Resource Estimate because number of orbitals (88) exceeds maximum specified in config (32).
-2024-12-14 16:50:35,717 - INFO - supporting data file UUID: 01a9aae3-1545-469e-8816-eda173836278.
-2024-12-14 16:50:35,717 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vtz.01a9aae3-1545-469e-8816-eda173836278.chk.
-2024-12-14 16:50:35,717 - INFO - assuming Sc1_vtz.01a9aae3-1545-469e-8816-eda173836278.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:50:35,723 - INFO - parsing ../problem_instances/problem_instance.si_h2_singlet_0.a0a07bfe-aac2-4d61-9425-009953899b3b.json
-2024-12-14 16:50:35,724 - INFO - problem_instance UUID: a0a07bfe-aac2-4d61-9425-009953899b3b
-2024-12-14 16:50:35,724 - INFO - problem_instance short name: si_h2_singlet_0
-2024-12-14 16:50:35,724 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 16:50:35,739 - INFO - Analyzing task 240f7830-f4e1-4301-b0af-ab8936851796...
-2024-12-14 16:50:35,740 - INFO - number of supporting files: 2
-2024-12-14 16:50:35,740 - INFO - supporting data file UUID: 7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.
-2024-12-14 16:50:35,740 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.gz.
-2024-12-14 16:50:35,740 - INFO - assuming fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.gz is an FCIDUMP file.
-2024-12-14 16:50:35,740 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.gz...
-2024-12-14 16:50:35,745 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:50:36,400 - INFO - Authentication (publickey) successful!
-2024-12-14 16:50:36,415 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:50:36,485 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:50:36,689 - INFO - ===============================================
-2024-12-14 16:50:36,689 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 286 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 297 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 298 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 299 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 300 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 301 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 302 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 305 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 306 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 307 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 308 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 309 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 310 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 311 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 312 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 313 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 314 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 315 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 316 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 317 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 318 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 319 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 16:52:00,343 - INFO - Circuit initialization time: 83.654342 seconds.
-2024-12-14 16:52:00,343 - INFO - Estimating logical resources...
-2024-12-14 16:52:18,127 - INFO - Resource estimation time (seconds): 17.783368
-2024-12-14 16:52:18,127 - INFO - supporting data file UUID: d08c3329-01e1-46ce-b57b-25dfe315271e.
-2024-12-14 16:52:18,127 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h2_singlet_cc-pVDZ.d08c3329-01e1-46ce-b57b-25dfe315271e.chk.
-2024-12-14 16:52:18,127 - INFO - assuming si_h2_singlet_cc-pVDZ.d08c3329-01e1-46ce-b57b-25dfe315271e.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:52:18,127 - INFO - Analyzing task 50de76ad-110a-4c09-836a-64cc60c87f9a...
-2024-12-14 16:52:18,127 - INFO - number of supporting files: 2
-2024-12-14 16:52:18,127 - INFO - supporting data file UUID: 5b274001-6cd6-436f-995f-d460d33688da.
-2024-12-14 16:52:18,128 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da.gz.
-2024-12-14 16:52:18,128 - INFO - assuming fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da.gz is an FCIDUMP file.
-2024-12-14 16:52:18,128 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da.gz...
-2024-12-14 16:52:18,133 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:52:18,761 - INFO - Authentication (publickey) successful!
-2024-12-14 16:52:18,776 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:54:32,185 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:55:32,735 - INFO - Skipping Logical Resource Estimate because number of orbitals (119) exceeds maximum specified in config (32).
-2024-12-14 16:55:32,736 - INFO - supporting data file UUID: b3da1264-d9ac-4834-bb78-01627f2b23d8.
-2024-12-14 16:55:32,736 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h2_singlet_cc-pVQZ.b3da1264-d9ac-4834-bb78-01627f2b23d8.chk.
-2024-12-14 16:55:32,736 - INFO - assuming si_h2_singlet_cc-pVQZ.b3da1264-d9ac-4834-bb78-01627f2b23d8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:55:32,737 - INFO - Analyzing task 5e1dcd34-1373-4f34-b9df-d738a8cf4db6...
-2024-12-14 16:55:32,737 - INFO - number of supporting files: 2
-2024-12-14 16:55:32,737 - INFO - supporting data file UUID: 0534fd24-c760-462e-b288-c3ea9fe721c8.
-2024-12-14 16:55:32,737 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8.gz.
-2024-12-14 16:55:32,738 - INFO - assuming fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8.gz is an FCIDUMP file.
-2024-12-14 16:55:32,738 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8.gz...
-2024-12-14 16:55:32,743 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:55:33,396 - INFO - Authentication (publickey) successful!
-2024-12-14 16:55:33,412 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:55:34,511 - INFO - [chan 0] sftp session closed.
-Downloading gsee/small_molecules/fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a.gz to fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a.gz...
-Parsing fcidump.p2_cc-pVDZ.7702bafa-2620-4d12-8ec6-e8c6246d385a
-Downloading gsee/small_molecules/fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02.gz to fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02.gz...
-Parsing fcidump.p2_cc-pVQZ.334dbd9d-2c13-4c76-8479-e82280065a02
-Downloading gsee/small_molecules/fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.gz to fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24.gz...
-Parsing fcidump.p2_cc-pVTZ.1ffb78a3-162a-43a4-a64c-d1d8fb0bce24
-Downloading gsee/small_molecules/fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7.gz to fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7.gz...
-Parsing fcidump.si_o_cc-pVDZ.ab244b36-ab52-4cce-b50a-2b04d8c548e7
-Downloading gsee/small_molecules/fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398.gz to fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398.gz...
-Parsing fcidump.si_o_cc-pVQZ.80214e7b-2e1f-440f-b9eb-ee9a16ed8398
-Downloading gsee/small_molecules/fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.gz to fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7.gz...
-Parsing fcidump.si_o_cc-pVTZ.1b1a93a4-a3cd-424f-87a2-c5a7ae5dbaf7
-Downloading gsee/small_molecules/fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.gz to fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17.gz...
-Parsing fcidump.h2_o_cc-pVDZ.96954db2-ef3e-47fd-82f8-2ac3cbfd6c17
-Downloading gsee/small_molecules/fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27.gz to fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27.gz...
-Parsing fcidump.h2_o_cc-pVQZ.26e93a92-0fb0-43bf-9c8d-6b97eb974d27
-Downloading gsee/small_molecules/fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2.gz to fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2.gz...
-Parsing fcidump.h2_o_cc-pVTZ.dd869557-00f9-421f-ab39-faa9d8e05df2
-Downloading gsee/small_molecules/fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329.gz to fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329.gz...
-Parsing fcidump.h_o_cl_cc-pVDZ.95dec49b-7d4e-4889-9e31-97e21db7b329
-Downloading gsee/small_molecules/fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.gz to fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d.gz...
-Parsing fcidump.h_o_cl_cc-pVTZ.e8ed1ee4-2780-4978-8d21-d1a23a30ae8d
-Downloading gsee/small_molecules/fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925.gz to fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925.gz...
-Parsing fcidump.c2_h6_cc-pVDZ.da21513f-c490-45e2-8ce9-1c7a511ca925
-Downloading gsee/planted_solutions/fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80.gz to fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80.gz...
-Parsing fcidump.planted_solution_0001.3add17d8-cb86-4ae5-8474-96d272269d80
-Downloading gsee/small_molecules/fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef.gz to fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef.gz...
-Parsing fcidump.c_h4_cc-pVDZ.a7321b5d-4730-4ace-9ff8-734ec07f3fef
-Downloading gsee/small_molecules/fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea.gz to fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea.gz...
-Parsing fcidump.c_h4_cc-pVTZ.47a5eadf-e31e-4c38-983f-8c75460463ea
-Downloading gsee/small_molecules/fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41.gz to fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41.gz...
-Parsing fcidump.V1_vdz.cf7aa422-2b82-4d7c-a031-8923e1fc8a41
-Downloading gsee/planted_solutions/fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350.gz to fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350.gz...
-Parsing fcidump.planted_solution_0007.c594d63e-29c7-462a-b385-f70c6d7d8350
-Downloading gsee/small_molecules/fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef.gz to fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef.gz...
-Parsing fcidump.Ti0_vdz.cdae3a0c-d613-4375-ab65-7088244b54ef
-Downloading gsee/small_molecules/fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407.gz to fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407.gz...
-Parsing fcidump.Ti0_vtz.7766bf7c-05db-4294-b125-6f0110aa9407
-Downloading gsee/small_molecules/fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55.gz to fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55.gz...
-Parsing fcidump.CrO_vdz.b9a18106-c719-4d0c-af12-30ded772eb55
-Downloading gsee/planted_solutions/fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7.gz to fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7.gz...
-Parsing fcidump.planted_solution_0002.16f9288f-be7e-4f8a-ab09-0153263f83c7
-Downloading gsee/small_molecules/fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e.gz to fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e.gz...
-Parsing fcidump.h3_c_o_h_cc-pVDZ.26a32758-4c43-4add-a12e-7273b2ddfd0e
-Downloading gsee/small_molecules/fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.gz to fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c.gz...
-Parsing fcidump.h3_c_o_h_cc-pVTZ.5f3af6fb-63d1-41cf-9e52-ea4fffcca51c
-Downloading gsee/small_molecules/fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.gz to fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18.gz...
-Parsing fcidump.Cr0_vdz.be2e7f6c-ccba-45ce-a42b-bd1d828b2d18
-Downloading gsee/small_molecules/fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.gz to fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411.gz...
-Parsing fcidump.Cr0_vtz.dd44b59c-f6b3-4f9a-acfe-34eaf6de3411
-Downloading gsee/small_molecules/fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193.gz to fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193.gz...
-Parsing fcidump.h2_o2_cc-pVDZ.459b2739-8810-4cd9-82c4-4285c36a0193
-Downloading gsee/small_molecules/fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.gz to fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65.gz...
-Parsing fcidump.h2_o2_cc-pVTZ.1a0cce83-5b61-4c4e-a5d4-8825a9b89f65
-Downloading gsee/small_molecules/fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa.gz to fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa.gz...
-Parsing fcidump.c_o_cc-pVDZ.5de3dbbd-1d79-45c9-ac75-4140ae123baa
-Downloading gsee/small_molecules/fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939.gz to fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939.gz...
-Parsing fcidump.c_o_cc-pVQZ.0c547725-1536-47b8-98f9-ed1384ceb939
-Downloading gsee/small_molecules/fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4.gz to fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4.gz...
-Parsing fcidump.c_o_cc-pVTZ.2b749f51-9ea9-41c4-9f67-e9c8334478c4
-Downloading gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz to fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz...
-Parsing fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3
-Downloading gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz to fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz...
-Parsing fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95
-Downloading gsee/small_molecules/fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz to fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz...
-Parsing fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a
-Downloading gsee/small_molecules/fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.gz to fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d.gz...
-Parsing fcidump.si_h2_singlet_cc-pVDZ.7fdb7bf4-2eed-4b4f-bf6f-767c7518367d
-Downloading gsee/small_molecules/fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da.gz to fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da.gz...
-Parsing fcidump.si_h2_singlet_cc-pVQZ.5b274001-6cd6-436f-995f-d460d33688da
-Downloading gsee/small_molecules/fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8.gz to fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8.gz...
-2024-12-14 16:55:39,799 - INFO - Skipping Logical Resource Estimate because number of orbitals (62) exceeds maximum specified in config (32).
-2024-12-14 16:55:39,799 - INFO - supporting data file UUID: fd38acc2-879f-4343-9948-f08f6e83f44c.
-2024-12-14 16:55:39,799 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/si_h2_singlet_cc-pVTZ.fd38acc2-879f-4343-9948-f08f6e83f44c.chk.
-2024-12-14 16:55:39,800 - INFO - assuming si_h2_singlet_cc-pVTZ.fd38acc2-879f-4343-9948-f08f6e83f44c.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 16:55:39,801 - INFO - parsing ../problem_instances/problem_instance.c_s_0.f90280cc-c860-4ff1-a9ec-4841cec989f7.json
-2024-12-14 16:55:39,802 - INFO - problem_instance UUID: f90280cc-c860-4ff1-a9ec-4841cec989f7
-2024-12-14 16:55:39,802 - INFO - problem_instance short name: c_s_0
-2024-12-14 16:55:39,802 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 16:55:39,817 - INFO - Analyzing task 886855d3-f1a7-4004-a736-417360e81d0a...
-2024-12-14 16:55:39,817 - INFO - number of supporting files: 2
-2024-12-14 16:55:39,817 - INFO - supporting data file UUID: 1c5f7390-3d26-4730-addd-b0fbd7591169.
-2024-12-14 16:55:39,817 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169.gz.
-2024-12-14 16:55:39,817 - INFO - assuming fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169.gz is an FCIDUMP file.
-2024-12-14 16:55:39,817 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169.gz...
-2024-12-14 16:55:39,823 - INFO - Connected (version 2.0, client 0)
-2024-12-14 16:55:40,470 - INFO - Authentication (publickey) successful!
-2024-12-14 16:55:40,485 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 16:55:40,651 - INFO - [chan 0] sftp session closed.
-2024-12-14 16:55:41,252 - INFO - ===============================================
-2024-12-14 16:55:41,252 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 388 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 392 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 393 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 394 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 17:00:05,003 - INFO - Circuit initialization time: 263.750947 seconds.
-2024-12-14 17:00:05,004 - INFO - Estimating logical resources...
-2024-12-14 17:00:34,108 - INFO - Resource estimation time (seconds): 29.104516
-2024-12-14 17:00:34,108 - INFO - supporting data file UUID: 402d1cfc-3809-48f1-8c2a-5c3faa18bdf8.
-2024-12-14 17:00:34,108 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_s_cc-pVDZ.402d1cfc-3809-48f1-8c2a-5c3faa18bdf8.chk.
-2024-12-14 17:00:34,108 - INFO - assuming c_s_cc-pVDZ.402d1cfc-3809-48f1-8c2a-5c3faa18bdf8.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:00:34,109 - INFO - Analyzing task 57830810-1133-4c19-9a19-30183dd86a9f...
-2024-12-14 17:00:34,109 - INFO - number of supporting files: 2
-2024-12-14 17:00:34,109 - INFO - supporting data file UUID: f895f408-4aa7-47e2-a903-c26b963b399e.
-2024-12-14 17:00:34,109 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e.gz.
-2024-12-14 17:00:34,109 - INFO - assuming fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e.gz is an FCIDUMP file.
-2024-12-14 17:00:34,109 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e.gz...
-2024-12-14 17:00:34,116 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:00:34,769 - INFO - Authentication (publickey) successful!
-2024-12-14 17:00:34,787 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:00:43,205 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:00:57,394 - INFO - Skipping Logical Resource Estimate because number of orbitals (64) exceeds maximum specified in config (32).
-2024-12-14 17:00:57,394 - INFO - supporting data file UUID: 3e7f8c2d-ae2e-446c-99ff-3366d03c24d5.
-2024-12-14 17:00:57,394 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_s_cc-pVTZ.3e7f8c2d-ae2e-446c-99ff-3366d03c24d5.chk.
-2024-12-14 17:00:57,394 - INFO - assuming c_s_cc-pVTZ.3e7f8c2d-ae2e-446c-99ff-3366d03c24d5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:00:57,396 - INFO - parsing ../problem_instances/problem_instance.h3_c_s_h_0.674b572a-3d6d-4418-8cc2-4755d90367ee.json
-2024-12-14 17:00:57,397 - INFO - problem_instance UUID: 674b572a-3d6d-4418-8cc2-4755d90367ee
-2024-12-14 17:00:57,397 - INFO - problem_instance short name: h3_c_s_h_0
-2024-12-14 17:00:57,397 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:00:57,413 - INFO - Analyzing task ff159145-fd97-486b-bf16-fc766b362ea3...
-2024-12-14 17:00:57,413 - INFO - number of supporting files: 2
-2024-12-14 17:00:57,413 - INFO - supporting data file UUID: 65a71ea2-097e-472c-b96a-13ddf6a0962c.
-2024-12-14 17:00:57,413 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c.gz.
-2024-12-14 17:00:57,413 - INFO - assuming fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c.gz is an FCIDUMP file.
-2024-12-14 17:00:57,413 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c.gz...
-2024-12-14 17:00:57,418 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:00:58,088 - INFO - Authentication (publickey) successful!
-2024-12-14 17:00:58,103 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:00:58,769 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:01:02,543 - INFO - Skipping Logical Resource Estimate because number of orbitals (52) exceeds maximum specified in config (32).
-2024-12-14 17:01:02,543 - INFO - supporting data file UUID: 2286fa4e-2324-4f1f-990e-6b397286e4d2.
-2024-12-14 17:01:02,543 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h3_c_s_h_cc-pVDZ.2286fa4e-2324-4f1f-990e-6b397286e4d2.chk.
-2024-12-14 17:01:02,543 - INFO - assuming h3_c_s_h_cc-pVDZ.2286fa4e-2324-4f1f-990e-6b397286e4d2.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:01:02,545 - INFO - parsing ../problem_instances/problem_instance.h_cl_0.586ce6a9-1876-459e-9b6c-be8bb1c4d1a5.json
-2024-12-14 17:01:02,545 - INFO - problem_instance UUID: 586ce6a9-1876-459e-9b6c-be8bb1c4d1a5
-2024-12-14 17:01:02,545 - INFO - problem_instance short name: h_cl_0
-2024-12-14 17:01:02,545 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 17:01:02,570 - INFO - Analyzing task fa3bc2a8-8067-4088-909a-2ddfa655ebfb...
-2024-12-14 17:01:02,570 - INFO - number of supporting files: 2
-2024-12-14 17:01:02,570 - INFO - supporting data file UUID: 5373214f-f344-4bdb-8840-5acf3b4c07c2.
-2024-12-14 17:01:02,570 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2.gz.
-2024-12-14 17:01:02,570 - INFO - assuming fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2.gz is an FCIDUMP file.
-2024-12-14 17:01:02,570 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2.gz...
-2024-12-14 17:01:02,577 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:01:03,081 - INFO - Authentication (publickey) successful!
-2024-12-14 17:01:03,103 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:01:03,492 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:01:03,615 - INFO - ===============================================
-2024-12-14 17:01:03,615 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 202 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 209 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 210 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 211 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 213 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 215 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 216 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 217 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 218 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 219 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 220 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 221 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 222 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 223 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 224 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 225 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 226 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 227 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 228 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 17:01:50,961 - INFO - Circuit initialization time: 47.345955 seconds.
-2024-12-14 17:01:50,961 - INFO - Estimating logical resources...
-2024-12-14 17:02:00,568 - INFO - Resource estimation time (seconds): 9.606271
-2024-12-14 17:02:00,568 - INFO - supporting data file UUID: 9d3c908b-f4dd-48a9-9c0b-2091b75c4f71.
-2024-12-14 17:02:00,568 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_cl_cc-pVDZ.9d3c908b-f4dd-48a9-9c0b-2091b75c4f71.chk.
-2024-12-14 17:02:00,568 - INFO - assuming h_cl_cc-pVDZ.9d3c908b-f4dd-48a9-9c0b-2091b75c4f71.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:02:00,568 - INFO - Analyzing task 8f39fc4f-91dc-4f67-ab5c-00e8ffc866c4...
-2024-12-14 17:02:00,568 - INFO - number of supporting files: 2
-2024-12-14 17:02:00,568 - INFO - supporting data file UUID: 1235d3d0-2c41-4036-909c-807ed3c89d96.
-2024-12-14 17:02:00,568 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96.gz.
-2024-12-14 17:02:00,568 - INFO - assuming fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96.gz is an FCIDUMP file.
-2024-12-14 17:02:00,568 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96.gz...
-2024-12-14 17:02:00,574 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:02:01,229 - INFO - Authentication (publickey) successful!
-2024-12-14 17:02:01,247 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:02:23,228 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:02:48,697 - INFO - Skipping Logical Resource Estimate because number of orbitals (89) exceeds maximum specified in config (32).
-2024-12-14 17:02:48,697 - INFO - supporting data file UUID: bb5112e8-2e25-44c8-b20c-55f6a6f5a9e5.
-2024-12-14 17:02:48,697 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_cl_cc-pVQZ.bb5112e8-2e25-44c8-b20c-55f6a6f5a9e5.chk.
-2024-12-14 17:02:48,697 - INFO - assuming h_cl_cc-pVQZ.bb5112e8-2e25-44c8-b20c-55f6a6f5a9e5.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:02:48,697 - INFO - Analyzing task f0637f33-3c53-4f01-8cf7-cfd9c6f39a51...
-2024-12-14 17:02:48,697 - INFO - number of supporting files: 2
-2024-12-14 17:02:48,697 - INFO - supporting data file UUID: 9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.
-2024-12-14 17:02:48,697 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.gz.
-2024-12-14 17:02:48,698 - INFO - assuming fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.gz is an FCIDUMP file.
-2024-12-14 17:02:48,698 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.gz...
-2024-12-14 17:02:48,702 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:02:49,362 - INFO - Authentication (publickey) successful!
-2024-12-14 17:02:49,375 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:02:49,622 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:02:51,825 - INFO - Skipping Logical Resource Estimate because number of orbitals (48) exceeds maximum specified in config (32).
-2024-12-14 17:02:51,825 - INFO - supporting data file UUID: 438599fa-dfe3-43b1-b0d9-e3d94412d2bb.
-2024-12-14 17:02:51,825 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/h_cl_cc-pVTZ.438599fa-dfe3-43b1-b0d9-e3d94412d2bb.chk.
-2024-12-14 17:02:51,825 - INFO - assuming h_cl_cc-pVTZ.438599fa-dfe3-43b1-b0d9-e3d94412d2bb.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:02:51,827 - INFO - parsing ../problem_instances/problem_instance.s_o2_0.1d0b8322-24b3-407a-8246-07444bb020be.json
-2024-12-14 17:02:51,827 - INFO - problem_instance UUID: 1d0b8322-24b3-407a-8246-07444bb020be
-2024-12-14 17:02:51,827 - INFO - problem_instance short name: s_o2_0
-2024-12-14 17:02:51,827 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 17:02:51,842 - INFO - Analyzing task c7cd47fa-1bbd-4859-a0c8-3fd5c287c6db...
-2024-12-14 17:02:51,842 - INFO - number of supporting files: 2
-2024-12-14 17:02:51,842 - INFO - supporting data file UUID: 42f8e26e-4707-41e4-8b0a-c099a8a4145c.
-2024-12-14 17:02:51,842 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c.gz.
-2024-12-14 17:02:51,842 - INFO - assuming fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c.gz is an FCIDUMP file.
-2024-12-14 17:02:51,842 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c.gz...
-2024-12-14 17:02:51,847 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:02:52,512 - INFO - Authentication (publickey) successful!
-2024-12-14 17:02:52,528 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:02:53,090 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:02:55,831 - INFO - Skipping Logical Resource Estimate because number of orbitals (46) exceeds maximum specified in config (32).
-2024-12-14 17:02:55,831 - INFO - supporting data file UUID: 8fff4715-cce7-4f70-8fda-582dc3ce714f.
-2024-12-14 17:02:55,831 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/s_o2_cc-pVDZ.8fff4715-cce7-4f70-8fda-582dc3ce714f.chk.
-2024-12-14 17:02:55,831 - INFO - assuming s_o2_cc-pVDZ.8fff4715-cce7-4f70-8fda-582dc3ce714f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:02:55,831 - INFO - Analyzing task 84243fc5-4284-4393-bb1d-b73bf600eb26...
-2024-12-14 17:02:55,831 - INFO - number of supporting files: 2
-2024-12-14 17:02:55,831 - INFO - supporting data file UUID: 189ad642-9d0f-4d5a-a1b3-1160f515ebf4.
-2024-12-14 17:02:55,831 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4.gz.
-2024-12-14 17:02:55,831 - INFO - assuming fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4.gz is an FCIDUMP file.
-2024-12-14 17:02:55,831 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4.gz...
-2024-12-14 17:02:55,838 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:02:56,462 - INFO - Authentication (publickey) successful!
-2024-12-14 17:02:56,475 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:03:54,457 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:04:34,531 - INFO - Skipping Logical Resource Estimate because number of orbitals (94) exceeds maximum specified in config (32).
-2024-12-14 17:04:34,531 - INFO - supporting data file UUID: f97e0487-8e45-4652-9e7f-911e68fa341b.
-2024-12-14 17:04:34,531 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/s_o2_cc-pVTZ.f97e0487-8e45-4652-9e7f-911e68fa341b.chk.
-2024-12-14 17:04:34,532 - INFO - assuming s_o2_cc-pVTZ.f97e0487-8e45-4652-9e7f-911e68fa341b.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:04:34,539 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0004.e0adafc5-789e-43e6-8f9e-e718da28de3a.json
-2024-12-14 17:04:34,705 - INFO - problem_instance UUID: e0adafc5-789e-43e6-8f9e-e718da28de3a
-2024-12-14 17:04:34,705 - INFO - problem_instance short name: planted_solution_0004
-2024-12-14 17:04:34,705 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:04:34,726 - INFO - Analyzing task c9809448-2f3d-40d4-858d-6288a4703af4...
-2024-12-14 17:04:34,726 - INFO - number of supporting files: 1
-2024-12-14 17:04:34,726 - INFO - supporting data file UUID: 52ddfe55-8758-448b-a6b1-3afdab85fdf4.
-2024-12-14 17:04:34,726 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4.gz.
-2024-12-14 17:04:34,726 - INFO - assuming fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4.gz is an FCIDUMP file.
-2024-12-14 17:04:34,726 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4.gz...
-2024-12-14 17:04:34,732 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:04:35,404 - INFO - Authentication (publickey) successful!
-2024-12-14 17:04:35,419 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:04:38,627 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:04:47,880 - INFO - Skipping Logical Resource Estimate because number of orbitals (70) exceeds maximum specified in config (32).
-2024-12-14 17:04:47,882 - INFO - parsing ../problem_instances/problem_instance.O_0.162f41da-af43-427c-a8bc-ae9fa97ace95.json
-2024-12-14 17:04:47,883 - INFO - problem_instance UUID: 162f41da-af43-427c-a8bc-ae9fa97ace95
-2024-12-14 17:04:47,883 - INFO - problem_instance short name: O_0
-2024-12-14 17:04:47,883 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 17:04:47,898 - INFO - Analyzing task 402d5237-16a3-4eb8-8bd4-5dcf2cb14c36...
-2024-12-14 17:04:47,898 - INFO - number of supporting files: 2
-2024-12-14 17:04:47,898 - INFO - supporting data file UUID: c3e26bde-f8e2-4e34-a833-9176dc6c5d58.
-2024-12-14 17:04:47,898 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58.gz.
-2024-12-14 17:04:47,898 - INFO - assuming fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58.gz is an FCIDUMP file.
-2024-12-14 17:04:47,898 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58.gz...
-2024-12-14 17:04:47,903 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:04:48,539 - INFO - Authentication (publickey) successful!
-2024-12-14 17:04:48,553 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:04:48,627 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:04:48,730 - INFO - ===============================================
-2024-12-14 17:04:48,730 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 183 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 187 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 188 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 189 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 190 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 191 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 192 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 193 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 194 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 195 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 196 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 197 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 198 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 199 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 200 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 201 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 202 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 17:05:11,239 - INFO - Circuit initialization time: 22.508807 seconds.
-2024-12-14 17:05:11,239 - INFO - Estimating logical resources...
-2024-12-14 17:05:19,238 - INFO - Resource estimation time (seconds): 7.99902
-2024-12-14 17:05:19,239 - INFO - supporting data file UUID: ea4019d6-415e-4efd-8627-d973327ce19e.
-2024-12-14 17:05:19,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O0_vdz.ea4019d6-415e-4efd-8627-d973327ce19e.chk.
-2024-12-14 17:05:19,239 - INFO - assuming O0_vdz.ea4019d6-415e-4efd-8627-d973327ce19e.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:05:19,239 - INFO - Analyzing task b4e88a1e-f05f-4ff7-bd91-b24a5073c6ca...
-2024-12-14 17:05:19,239 - INFO - number of supporting files: 2
-2024-12-14 17:05:19,239 - INFO - supporting data file UUID: 31ade416-8bd1-4671-953c-c62f281cd96d.
-2024-12-14 17:05:19,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d.gz.
-2024-12-14 17:05:19,239 - INFO - assuming fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d.gz is an FCIDUMP file.
-2024-12-14 17:05:19,239 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d.gz...
-2024-12-14 17:05:19,244 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:19,952 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:19,967 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:05:23,311 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:05:33,162 - INFO - Skipping Logical Resource Estimate because number of orbitals (79) exceeds maximum specified in config (32).
-2024-12-14 17:05:33,162 - INFO - supporting data file UUID: 2b1cc7fa-5247-4518-8fdb-3e467de4c483.
-2024-12-14 17:05:33,162 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O0_vqz.2b1cc7fa-5247-4518-8fdb-3e467de4c483.chk.
-2024-12-14 17:05:33,162 - INFO - assuming O0_vqz.2b1cc7fa-5247-4518-8fdb-3e467de4c483.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:05:33,162 - INFO - Analyzing task 85a3a8d6-f2c7-458c-bbc3-25fd76d9afc0...
-2024-12-14 17:05:33,162 - INFO - number of supporting files: 2
-2024-12-14 17:05:33,162 - INFO - supporting data file UUID: 1661aaae-621a-430d-990a-bcbbbe270dfb.
-2024-12-14 17:05:33,162 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb.gz.
-2024-12-14 17:05:33,162 - INFO - assuming fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb.gz is an FCIDUMP file.
-2024-12-14 17:05:33,162 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb.gz...
-2024-12-14 17:05:33,167 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:33,824 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:33,842 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:05:33,949 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:05:34,941 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:05:34,941 - INFO - supporting data file UUID: dad8825d-6a27-4f7f-87a6-4bcfad39bdb9.
-2024-12-14 17:05:34,941 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/O0_vtz.dad8825d-6a27-4f7f-87a6-4bcfad39bdb9.chk.
-2024-12-14 17:05:34,941 - INFO - assuming O0_vtz.dad8825d-6a27-4f7f-87a6-4bcfad39bdb9.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:05:34,943 - INFO - parsing ../problem_instances/problem_instance.ozone.9560107e-f1ad-4480-aa51-ef03edda6e19.json
-2024-12-14 17:05:34,943 - INFO - problem_instance UUID: 9560107e-f1ad-4480-aa51-ef03edda6e19
-2024-12-14 17:05:34,943 - INFO - problem_instance short name: ozone
-2024-12-14 17:05:34,943 - INFO - contains 6 associated Hamiltonians.
-2024-12-14 17:05:34,958 - INFO - Analyzing task 881f5275-83eb-470c-80fe-eebb7ced30e9...
-2024-12-14 17:05:34,958 - INFO - number of supporting files: 1
-2024-12-14 17:05:34,958 - INFO - supporting data file UUID: b0c72570-cf06-4ecc-ae64-52a65720c849.
-2024-12-14 17:05:34,958 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849.gz.
-2024-12-14 17:05:34,959 - INFO - assuming FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849.gz is an FCIDUMP file.
-2024-12-14 17:05:34,959 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849.gz...
-2024-12-14 17:05:34,964 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:35,597 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:35,615 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:05:35,797 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:05:37,238 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 17:05:37,238 - INFO - Analyzing task e0de65ed-e45e-46e0-a57b-c6ad4efbdafe...
-2024-12-14 17:05:37,238 - INFO - number of supporting files: 1
-2024-12-14 17:05:37,239 - INFO - supporting data file UUID: 598f7475-c056-4a46-8d20-5159c73e5d02.
-2024-12-14 17:05:37,239 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02.gz.
-2024-12-14 17:05:37,239 - INFO - assuming FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02.gz is an FCIDUMP file.
-2024-12-14 17:05:37,239 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02.gz...
-2024-12-14 17:05:37,244 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:37,903 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:37,919 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:05:37,980 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:05:38,007 - INFO - ===============================================
-2024-12-14 17:05:38,007 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 109 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 111 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 17:05:47,402 - INFO - Circuit initialization time: 9.394373 seconds.
-2024-12-14 17:05:47,402 - INFO - Estimating logical resources...
-2024-12-14 17:05:50,596 - INFO - Resource estimation time (seconds): 3.193997
-2024-12-14 17:05:50,596 - INFO - Analyzing task 6918e02b-1e04-40bf-a800-1c9ed100d261...
-2024-12-14 17:05:50,596 - INFO - number of supporting files: 1
-2024-12-14 17:05:50,596 - INFO - supporting data file UUID: 8fc9b179-ff7d-4402-b0cf-18ec074b211a.
-2024-12-14 17:05:50,597 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a.gz.
-2024-12-14 17:05:50,597 - INFO - assuming FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a.gz is an FCIDUMP file.
-2024-12-14 17:05:50,597 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a.gz...
-2024-12-14 17:05:50,602 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:05:51,273 - INFO - Authentication (publickey) successful!
-2024-12-14 17:05:51,290 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:06:16,838 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:06:38,318 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 17:06:38,318 - INFO - Analyzing task a2ad41b8-37bb-44e1-be3e-df1052952e9c...
-2024-12-14 17:06:38,318 - INFO - number of supporting files: 1
-2024-12-14 17:06:38,318 - INFO - supporting data file UUID: 1a42101c-3c00-4105-8ed3-9275bf0d18db.
-2024-12-14 17:06:38,318 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db.gz.
-2024-12-14 17:06:38,318 - INFO - assuming FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db.gz is an FCIDUMP file.
-2024-12-14 17:06:38,318 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db.gz...
-2024-12-14 17:06:38,327 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:06:39,006 - INFO - Authentication (publickey) successful!
-2024-12-14 17:06:39,020 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:06:39,180 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:06:40,528 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 17:06:40,528 - INFO - Analyzing task b4968ccd-6711-4173-8f80-f16094b3e0cd...
-2024-12-14 17:06:40,528 - INFO - number of supporting files: 1
-2024-12-14 17:06:40,529 - INFO - supporting data file UUID: 93698b08-3188-4961-b551-50ac2c1e62b3.
-2024-12-14 17:06:40,529 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3.gz.
-2024-12-14 17:06:40,529 - INFO - assuming FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3.gz is an FCIDUMP file.
-2024-12-14 17:06:40,529 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3.gz...
-2024-12-14 17:06:40,535 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:06:41,190 - INFO - Authentication (publickey) successful!
-2024-12-14 17:06:41,207 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:06:41,290 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:06:41,325 - INFO - ===============================================
-2024-12-14 17:06:41,325 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 108 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 109 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 110 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 17:06:50,396 - INFO - Circuit initialization time: 9.070894 seconds.
-2024-12-14 17:06:50,396 - INFO - Estimating logical resources...
-2024-12-14 17:06:53,482 - INFO - Resource estimation time (seconds): 3.086139
-2024-12-14 17:06:53,482 - INFO - Analyzing task ee2925f1-a302-4c21-b33c-5cb30b10270f...
-2024-12-14 17:06:53,483 - INFO - number of supporting files: 1
-2024-12-14 17:06:53,483 - INFO - supporting data file UUID: 8b6ad6f7-f004-4941-95b2-829eb3723c8d.
-2024-12-14 17:06:53,483 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d.gz.
-2024-12-14 17:06:53,483 - INFO - assuming FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d.gz is an FCIDUMP file.
-2024-12-14 17:06:53,483 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d.gz...
-2024-12-14 17:06:53,488 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:06:54,162 - INFO - Authentication (publickey) successful!
-2024-12-14 17:06:54,177 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:07:17,634 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:07:43,783 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 17:07:43,790 - INFO - parsing ../problem_instances/problem_instance.c_h2_singlet_0.7ca1486c-06a5-47c1-b8ab-eab491ffc68b.json
-2024-12-14 17:07:43,790 - INFO - problem_instance UUID: 7ca1486c-06a5-47c1-b8ab-eab491ffc68b
-2024-12-14 17:07:43,790 - INFO - problem_instance short name: c_h2_singlet_0
-2024-12-14 17:07:43,790 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 17:07:43,806 - INFO - Analyzing task 5f0ac7ac-1dcc-46a6-bfa0-6e76c73a0bdd...
-2024-12-14 17:07:43,806 - INFO - number of supporting files: 2
-2024-12-14 17:07:43,806 - INFO - supporting data file UUID: 290cfb48-dbdd-4915-bbaf-b0bc69fa070c.
-2024-12-14 17:07:43,806 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c.gz.
-2024-12-14 17:07:43,806 - INFO - assuming fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c.gz is an FCIDUMP file.
-2024-12-14 17:07:43,806 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c.gz...
-2024-12-14 17:07:43,815 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:07:44,466 - INFO - Authentication (publickey) successful!
-2024-12-14 17:07:44,482 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:07:44,559 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:07:44,647 - INFO - ===============================================
-2024-12-14 17:07:44,647 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 242 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 246 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 247 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 252 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 254 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 256 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 257 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 258 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 259 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 260 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 261 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 262 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 263 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 264 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 265 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 266 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:181: RuntimeWarning: divide by zero encountered in scalar divide
-  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
-2024-12-14 17:08:33,929 - INFO - Circuit initialization time: 49.281288 seconds.
-2024-12-14 17:08:33,929 - INFO - Estimating logical resources...
-2024-12-14 17:08:45,865 - INFO - Resource estimation time (seconds): 11.936132
-2024-12-14 17:08:45,865 - INFO - supporting data file UUID: c8a8bb7f-6183-4ee2-83f9-ca7dc4127c36.
-2024-12-14 17:08:45,865 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h2_singlet_cc-pVDZ.c8a8bb7f-6183-4ee2-83f9-ca7dc4127c36.chk.
-2024-12-14 17:08:45,866 - INFO - assuming c_h2_singlet_cc-pVDZ.c8a8bb7f-6183-4ee2-83f9-ca7dc4127c36.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:08:45,866 - INFO - Analyzing task 6a16e45d-545d-4827-9617-3c83fb323a97...
-2024-12-14 17:08:45,866 - INFO - number of supporting files: 2
-2024-12-14 17:08:45,866 - INFO - supporting data file UUID: 7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.
-2024-12-14 17:08:45,866 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.gz.
-2024-12-14 17:08:45,866 - INFO - assuming fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.gz is an FCIDUMP file.
-2024-12-14 17:08:45,866 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.gz...
-2024-12-14 17:08:45,871 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:08:46,526 - INFO - Authentication (publickey) successful!
-2024-12-14 17:08:46,540 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:10:07,438 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:10:51,443 - INFO - Skipping Logical Resource Estimate because number of orbitals (115) exceeds maximum specified in config (32).
-2024-12-14 17:10:51,443 - INFO - supporting data file UUID: 755431d2-689c-4d9f-a421-8b19082b1d8d.
-2024-12-14 17:10:51,443 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h2_singlet_cc-pVQZ.755431d2-689c-4d9f-a421-8b19082b1d8d.chk.
-2024-12-14 17:10:51,443 - INFO - assuming c_h2_singlet_cc-pVQZ.755431d2-689c-4d9f-a421-8b19082b1d8d.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:10:51,443 - INFO - Analyzing task 8fa0ddcf-9b98-4144-8250-522f38c28b02...
-2024-12-14 17:10:51,443 - INFO - number of supporting files: 2
-2024-12-14 17:10:51,443 - INFO - supporting data file UUID: 59fca8b4-25f4-44f7-b961-34d6a4037051.
-2024-12-14 17:10:51,443 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051.gz.
-2024-12-14 17:10:51,443 - INFO - assuming fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051.gz is an FCIDUMP file.
-2024-12-14 17:10:51,443 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051.gz...
-2024-12-14 17:10:51,447 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:10:52,074 - INFO - Authentication (publickey) successful!
-2024-12-14 17:10:52,092 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:10:52,555 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:10:54,416 - INFO - Skipping Logical Resource Estimate because number of orbitals (58) exceeds maximum specified in config (32).
-2024-12-14 17:10:54,416 - INFO - supporting data file UUID: 3accd35c-ae52-4f9b-9a98-a9069b1768d3.
-2024-12-14 17:10:54,416 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_h2_singlet_cc-pVTZ.3accd35c-ae52-4f9b-9a98-a9069b1768d3.chk.
-2024-12-14 17:10:54,417 - INFO - assuming c_h2_singlet_cc-pVTZ.3accd35c-ae52-4f9b-9a98-a9069b1768d3.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:10:54,418 - INFO - parsing ../problem_instances/problem_instance.VO_0.bcc86483-2a7e-4271-b6fc-238ef5e682f6.json
-2024-12-14 17:10:54,418 - INFO - problem_instance UUID: bcc86483-2a7e-4271-b6fc-238ef5e682f6
-2024-12-14 17:10:54,418 - INFO - problem_instance short name: VO_0
-2024-12-14 17:10:54,418 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:10:54,428 - INFO - Analyzing task 63c089b2-1940-4301-89d6-93ecc98c07f1...
-2024-12-14 17:10:54,428 - INFO - number of supporting files: 2
-2024-12-14 17:10:54,428 - INFO - supporting data file UUID: c6137fbe-c5ef-4572-9e3a-3261e9acaca0.
-2024-12-14 17:10:54,428 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0.gz.
-2024-12-14 17:10:54,429 - INFO - assuming fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0.gz is an FCIDUMP file.
-2024-12-14 17:10:54,429 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0.gz...
-2024-12-14 17:10:54,434 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:10:55,096 - INFO - Authentication (publickey) successful!
-2024-12-14 17:10:55,112 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:11:22,867 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:11:50,687 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 17:11:50,687 - INFO - supporting data file UUID: 033989fa-5cc5-4ca2-8e7a-a567b823a18f.
-2024-12-14 17:11:50,687 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/VO_vdz.033989fa-5cc5-4ca2-8e7a-a567b823a18f.chk.
-2024-12-14 17:11:50,687 - INFO - assuming VO_vdz.033989fa-5cc5-4ca2-8e7a-a567b823a18f.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:11:50,689 - INFO - parsing ../problem_instances/problem_instance.planted_solution_0005.7e0fb928-b0a9-4b44-89f1-7e0ee3b2bb13.json
-2024-12-14 17:11:50,691 - INFO - problem_instance UUID: 7e0fb928-b0a9-4b44-89f1-7e0ee3b2bb13
-2024-12-14 17:11:50,691 - INFO - problem_instance short name: planted_solution_0005
-2024-12-14 17:11:50,691 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:11:50,706 - INFO - Analyzing task a41a284c-7baa-438e-9323-532091c7a78f...
-2024-12-14 17:11:50,707 - INFO - number of supporting files: 1
-2024-12-14 17:11:50,707 - INFO - supporting data file UUID: 0ddeaaab-a6ef-436b-8189-290afa6408ea.
-2024-12-14 17:11:50,707 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea.gz.
-2024-12-14 17:11:50,707 - INFO - assuming fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea.gz is an FCIDUMP file.
-2024-12-14 17:11:50,707 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/planted_solutions/fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea.gz...
-2024-12-14 17:11:50,712 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:11:51,369 - INFO - Authentication (publickey) successful!
-2024-12-14 17:11:51,387 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:11:51,468 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:11:51,486 - INFO - ===============================================
-2024-12-14 17:11:51,486 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 17:12:00,323 - INFO - Circuit initialization time: 8.83671 seconds.
-2024-12-14 17:12:00,323 - INFO - Estimating logical resources...
-2024-12-14 17:12:01,461 - INFO - Resource estimation time (seconds): 1.137834
-2024-12-14 17:12:01,463 - INFO - parsing ../problem_instances/problem_instance.ru_mono.7213642b-5f16-48be-d5e5-2bc42ebb8526.json
-2024-12-14 17:12:01,463 - INFO - problem_instance UUID: 7213642b-5f16-48be-d5e5-2bc42ebb8526
-2024-12-14 17:12:01,463 - INFO - problem_instance short name: ru_mono
-2024-12-14 17:12:01,463 - INFO - contains 6 associated Hamiltonians.
-2024-12-14 17:12:01,478 - INFO - Analyzing task 5509795a-90ce-45d6-b03d-db956a5da5b2...
-2024-12-14 17:12:01,478 - INFO - number of supporting files: 1
-2024-12-14 17:12:01,478 - INFO - supporting data file UUID: cb60079d-5a30-4e3a-89d5-dbe95822df5e.
-2024-12-14 17:12:01,479 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e.gz.
-2024-12-14 17:12:01,479 - INFO - assuming fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e.gz is an FCIDUMP file.
-2024-12-14 17:12:01,479 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e.gz...
-2024-12-14 17:12:01,484 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:02,140 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:02,155 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:02,214 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:02,219 - INFO - ===============================================
-2024-12-14 17:12:02,219 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 17:12:05,424 - INFO - Circuit initialization time: 3.204817 seconds.
-2024-12-14 17:12:05,424 - INFO - Estimating logical resources...
-2024-12-14 17:12:06,612 - INFO - Resource estimation time (seconds): 1.188307
-2024-12-14 17:12:06,613 - INFO - Analyzing task bc3520b5-bf25-4a43-892c-8d7e9a690fe2...
-2024-12-14 17:12:06,613 - INFO - number of supporting files: 1
-2024-12-14 17:12:06,613 - INFO - supporting data file UUID: 4811297e-a8df-4150-9d4d-376fd0c6e9cd.
-2024-12-14 17:12:06,613 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd.gz.
-2024-12-14 17:12:06,613 - INFO - assuming fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd.gz is an FCIDUMP file.
-2024-12-14 17:12:06,613 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd.gz...
-2024-12-14 17:12:06,619 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:07,258 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:07,275 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:07,389 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:07,992 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 17:12:07,992 - INFO - Analyzing task d937e005-3688-4138-9465-426798087395...
-2024-12-14 17:12:07,992 - INFO - number of supporting files: 1
-2024-12-14 17:12:07,992 - INFO - supporting data file UUID: 30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.
-2024-12-14 17:12:07,993 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.gz.
-2024-12-14 17:12:07,993 - INFO - assuming fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.gz is an FCIDUMP file.
-2024-12-14 17:12:07,993 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.gz...
-2024-12-14 17:12:07,998 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:08,648 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:08,666 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:08,722 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:08,734 - INFO - ===============================================
-2024-12-14 17:12:08,734 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 17:12:12,147 - INFO - Circuit initialization time: 3.413223 seconds.
-2024-12-14 17:12:12,147 - INFO - Estimating logical resources...
-2024-12-14 17:12:13,020 - INFO - Resource estimation time (seconds): 0.872327
-2024-12-14 17:12:13,020 - INFO - Analyzing task ace55695-1ca9-4153-8fd4-55ed6658cf8c...
-2024-12-14 17:12:13,020 - INFO - number of supporting files: 1
-2024-12-14 17:12:13,020 - INFO - supporting data file UUID: a2417602-4e97-4395-b3f0-1e29262c8053.
-2024-12-14 17:12:13,020 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053.gz.
-2024-12-14 17:12:13,020 - INFO - assuming fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053.gz is an FCIDUMP file.
-2024-12-14 17:12:13,020 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053.gz...
-2024-12-14 17:12:13,025 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:13,671 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:13,687 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:13,825 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:14,581 - INFO - Skipping Logical Resource Estimate because number of orbitals (36) exceeds maximum specified in config (32).
-2024-12-14 17:12:14,581 - INFO - Analyzing task dab492c3-27fe-4ac3-8c98-de2563caf66c...
-2024-12-14 17:12:14,581 - INFO - number of supporting files: 1
-2024-12-14 17:12:14,581 - INFO - supporting data file UUID: 51f7d629-9a0e-4688-8562-59a5f0c0a404.
-2024-12-14 17:12:14,581 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404.gz.
-2024-12-14 17:12:14,581 - INFO - assuming fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404.gz is an FCIDUMP file.
-2024-12-14 17:12:14,581 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404.gz...
-2024-12-14 17:12:14,586 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:15,231 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:15,246 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:15,300 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:15,304 - INFO - ===============================================
-2024-12-14 17:12:15,305 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 17:12:18,439 - INFO - Circuit initialization time: 3.133947 seconds.
-2024-12-14 17:12:18,439 - INFO - Estimating logical resources...
-2024-12-14 17:12:19,421 - INFO - Resource estimation time (seconds): 0.981753
-2024-12-14 17:12:19,421 - INFO - Analyzing task a475af8e-cb0b-4533-906d-a6b8eda313e7...
-2024-12-14 17:12:19,421 - INFO - number of supporting files: 1
-2024-12-14 17:12:19,421 - INFO - supporting data file UUID: 7be1766a-b3f7-4779-9a69-f4358645831b.
-2024-12-14 17:12:19,421 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b.gz.
-2024-12-14 17:12:19,421 - INFO - assuming fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b.gz is an FCIDUMP file.
-2024-12-14 17:12:19,421 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b.gz...
-2024-12-14 17:12:19,426 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:20,090 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:20,107 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:20,214 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:20,618 - INFO - Skipping Logical Resource Estimate because number of orbitals (34) exceeds maximum specified in config (32).
-2024-12-14 17:12:20,619 - INFO - parsing ../problem_instances/problem_instance.mo2_n2.90d4e4fc-1216-4846-b45f-198c0530e29b.json
-2024-12-14 17:12:20,619 - INFO - problem_instance UUID: 90d4e4fc-1216-4846-b45f-198c0530e29b
-2024-12-14 17:12:20,619 - INFO - problem_instance short name: mo2_n2
-2024-12-14 17:12:20,620 - INFO - contains 3 associated Hamiltonians.
-2024-12-14 17:12:20,630 - INFO - Analyzing task e3a07092-d1e5-4867-a4d7-d0258f9df6db...
-2024-12-14 17:12:20,630 - INFO - number of supporting files: 1
-2024-12-14 17:12:20,630 - INFO - supporting data file UUID: 09c3ddd5-0187-46e8-95c3-157c470cb69a.
-2024-12-14 17:12:20,630 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a.gz.
-2024-12-14 17:12:20,630 - INFO - assuming fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a.gz is an FCIDUMP file.
-2024-12-14 17:12:20,630 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a.gz...
-2024-12-14 17:12:20,635 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:21,276 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:21,289 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:25,153 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:35,065 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 17:12:35,066 - INFO - Analyzing task 138733f0-08f5-4077-b848-813c8ec53c79...
-2024-12-14 17:12:35,066 - INFO - number of supporting files: 1
-2024-12-14 17:12:35,066 - INFO - supporting data file UUID: f36a9dbc-c34a-401f-8ea6-dc996d785edf.
-2024-12-14 17:12:35,066 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf.gz.
-2024-12-14 17:12:35,066 - INFO - assuming fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf.gz is an FCIDUMP file.
-2024-12-14 17:12:35,066 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf.gz...
-2024-12-14 17:12:35,076 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:35,744 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:35,788 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:40,594 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:12:48,125 - INFO - Skipping Logical Resource Estimate because number of orbitals (70) exceeds maximum specified in config (32).
-2024-12-14 17:12:48,126 - INFO - Analyzing task 79b74ad4-afa8-458f-87a3-a5ec339056c6...
-2024-12-14 17:12:48,126 - INFO - number of supporting files: 1
-2024-12-14 17:12:48,126 - INFO - supporting data file UUID: 9cba211b-820c-4ad4-a050-336e8049e1c7.
-2024-12-14 17:12:48,126 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7.gz.
-2024-12-14 17:12:48,126 - INFO - assuming fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7.gz is an FCIDUMP file.
-2024-12-14 17:12:48,126 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7.gz...
-2024-12-14 17:12:48,131 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:12:48,773 - INFO - Authentication (publickey) successful!
-2024-12-14 17:12:48,789 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:12:52,626 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:02,349 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 17:13:02,350 - INFO - parsing ../problem_instances/problem_instance.MnO_0.e2212cdf-adef-454a-b218-05041d723c55.json
-2024-12-14 17:13:02,350 - INFO - problem_instance UUID: e2212cdf-adef-454a-b218-05041d723c55
-2024-12-14 17:13:02,351 - INFO - problem_instance short name: MnO_0
-2024-12-14 17:13:02,351 - INFO - contains 1 associated Hamiltonians.
-2024-12-14 17:13:02,366 - INFO - Analyzing task f0ee8150-86e2-4f9e-ae35-95af38f3c69e...
-2024-12-14 17:13:02,366 - INFO - number of supporting files: 2
-2024-12-14 17:13:02,366 - INFO - supporting data file UUID: 55355f72-52f0-427d-b5ac-3b41666ca5fb.
-2024-12-14 17:13:02,366 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb.gz.
-2024-12-14 17:13:02,366 - INFO - assuming fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb.gz is an FCIDUMP file.
-2024-12-14 17:13:02,366 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb.gz...
-2024-12-14 17:13:02,371 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:02,997 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:03,018 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:10,564 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:24,502 - INFO - Skipping Logical Resource Estimate because number of orbitals (76) exceeds maximum specified in config (32).
-2024-12-14 17:13:24,502 - INFO - supporting data file UUID: fcdc3853-9542-4586-a0bc-9ec19df6a63a.
-2024-12-14 17:13:24,502 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/MnO_vdz.fcdc3853-9542-4586-a0bc-9ec19df6a63a.chk.
-2024-12-14 17:13:24,503 - INFO - assuming MnO_vdz.fcdc3853-9542-4586-a0bc-9ec19df6a63a.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:13:24,504 - INFO - parsing ../problem_instances/problem_instance.mo_n2_pincer.8a3787cc-d3d0-42a8-d9a9-7de2aed45208.json
-2024-12-14 17:13:24,505 - INFO - problem_instance UUID: 8a3787cc-d3d0-42a8-d9a9-7de2aed45208
-2024-12-14 17:13:24,505 - INFO - problem_instance short name: mo_n2_pincer
-2024-12-14 17:13:24,505 - INFO - contains 16 associated Hamiltonians.
-2024-12-14 17:13:24,520 - INFO - Analyzing task aaae8d93-cb88-41ee-8f11-c70cc9b0d7fb...
-2024-12-14 17:13:24,520 - INFO - number of supporting files: 1
-2024-12-14 17:13:24,520 - INFO - supporting data file UUID: 4476d0ff-9618-4774-9619-e3f223249cea.
-2024-12-14 17:13:24,520 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea.gz.
-2024-12-14 17:13:24,521 - INFO - assuming fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea.gz is an FCIDUMP file.
-2024-12-14 17:13:24,521 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea.gz...
-2024-12-14 17:13:24,526 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:25,176 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:25,192 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:25,845 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:29,770 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 17:13:29,770 - INFO - Analyzing task 5547bb48-fac6-4426-91ad-c4853ce421aa...
-2024-12-14 17:13:29,770 - INFO - number of supporting files: 1
-2024-12-14 17:13:29,770 - INFO - supporting data file UUID: d74d0c01-8507-445b-bec1-f02bafbbfaab.
-2024-12-14 17:13:29,770 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab.gz.
-2024-12-14 17:13:29,771 - INFO - assuming fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab.gz is an FCIDUMP file.
-2024-12-14 17:13:29,771 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab.gz...
-2024-12-14 17:13:29,783 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:30,430 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:30,445 - INFO - [chan 0] Opened sftp connection (server version 3)
-Parsing fcidump.si_h2_singlet_cc-pVTZ.0534fd24-c760-462e-b288-c3ea9fe721c8
-Downloading gsee/small_molecules/fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169.gz to fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169.gz...
-Parsing fcidump.c_s_cc-pVDZ.1c5f7390-3d26-4730-addd-b0fbd7591169
-Downloading gsee/small_molecules/fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e.gz to fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e.gz...
-Parsing fcidump.c_s_cc-pVTZ.f895f408-4aa7-47e2-a903-c26b963b399e
-Downloading gsee/small_molecules/fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c.gz to fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c.gz...
-Parsing fcidump.h3_c_s_h_cc-pVDZ.65a71ea2-097e-472c-b96a-13ddf6a0962c
-Downloading gsee/small_molecules/fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2.gz to fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2.gz...
-Parsing fcidump.h_cl_cc-pVDZ.5373214f-f344-4bdb-8840-5acf3b4c07c2
-Downloading gsee/small_molecules/fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96.gz to fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96.gz...
-Parsing fcidump.h_cl_cc-pVQZ.1235d3d0-2c41-4036-909c-807ed3c89d96
-Downloading gsee/small_molecules/fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.gz to fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a.gz...
-Parsing fcidump.h_cl_cc-pVTZ.9ef07114-7e1a-4eba-a9ac-2c71c5fd518a
-Downloading gsee/small_molecules/fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c.gz to fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c.gz...
-Parsing fcidump.s_o2_cc-pVDZ.42f8e26e-4707-41e4-8b0a-c099a8a4145c
-Downloading gsee/small_molecules/fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4.gz to fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4.gz...
-Parsing fcidump.s_o2_cc-pVTZ.189ad642-9d0f-4d5a-a1b3-1160f515ebf4
-Downloading gsee/planted_solutions/fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4.gz to fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4.gz...
-Parsing fcidump.planted_solution_0004.52ddfe55-8758-448b-a6b1-3afdab85fdf4
-Downloading gsee/small_molecules/fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58.gz to fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58.gz...
-Parsing fcidump.O0_vdz.c3e26bde-f8e2-4e34-a833-9176dc6c5d58
-Downloading gsee/small_molecules/fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d.gz to fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d.gz...
-Parsing fcidump.O0_vqz.31ade416-8bd1-4671-953c-c62f281cd96d
-Downloading gsee/small_molecules/fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb.gz to fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb.gz...
-Parsing fcidump.O0_vtz.1661aaae-621a-430d-990a-bcbbbe270dfb
-Downloading gsee/FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849.gz to FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849.gz...
-Parsing FCIDUMP_g_ring_b_cc-pvdz.b0c72570-cf06-4ecc-ae64-52a65720c849
-Downloading gsee/FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02.gz to FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02.gz...
-Parsing FCIDUMP_g_ring_b_sto-3g.598f7475-c056-4a46-8d20-5159c73e5d02
-Downloading gsee/FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a.gz to FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a.gz...
-Parsing FCIDUMP_g_ring_b_cc-pvtz.8fc9b179-ff7d-4402-b0cf-18ec074b211a
-Downloading gsee/FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db.gz to FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db.gz...
-Parsing FCIDUMP_g_bent_b_cc-pvdz.1a42101c-3c00-4105-8ed3-9275bf0d18db
-Downloading gsee/FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3.gz to FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3.gz...
-Parsing FCIDUMP_g_bent_b_sto-3g.93698b08-3188-4961-b551-50ac2c1e62b3
-Downloading gsee/FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d.gz to FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d.gz...
-Parsing FCIDUMP_g_bent_b_cc-pvtz.8b6ad6f7-f004-4941-95b2-829eb3723c8d
-Downloading gsee/small_molecules/fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c.gz to fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c.gz...
-Parsing fcidump.c_h2_singlet_cc-pVDZ.290cfb48-dbdd-4915-bbaf-b0bc69fa070c
-Downloading gsee/small_molecules/fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.gz to fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978.gz...
-Parsing fcidump.c_h2_singlet_cc-pVQZ.7db2ffef-bfc4-4df3-b6a6-c3929e0bb978
-Downloading gsee/small_molecules/fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051.gz to fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051.gz...
-Parsing fcidump.c_h2_singlet_cc-pVTZ.59fca8b4-25f4-44f7-b961-34d6a4037051
-Downloading gsee/small_molecules/fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0.gz to fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0.gz...
-Parsing fcidump.VO_vdz.c6137fbe-c5ef-4572-9e3a-3261e9acaca0
-Downloading gsee/planted_solutions/fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea.gz to fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea.gz...
-Parsing fcidump.planted_solution_0005.0ddeaaab-a6ef-436b-8189-290afa6408ea
-Downloading gsee/fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e.gz to fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e.gz...
-Parsing fcidump.32_2ru_III_3pl_noncan_0.2_new.cb60079d-5a30-4e3a-89d5-dbe95822df5e
-Downloading gsee/fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd.gz to fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd.gz...
-Parsing fcidump.33_2ru_III_3pl_noncan_0.2_new.4811297e-a8df-4150-9d4d-376fd0c6e9cd
-Downloading gsee/fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.gz to fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b.gz...
-Parsing fcidump.34_3ruo_IV_2pl_noncan_0.2_new.30c3e4f9-1b24-4fe5-9cab-ad0b67e0d74b
-Downloading gsee/fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053.gz to fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053.gz...
-Parsing fcidump.35_3ruo_IV_2pl_noncan_0.2_new.a2417602-4e97-4395-b3f0-1e29262c8053
-Downloading gsee/fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404.gz to fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404.gz...
-Parsing fcidump.36_1ru_II_2pl_noncan_0.2_new.51f7d629-9a0e-4688-8562-59a5f0c0a404
-Downloading gsee/fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b.gz to fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b.gz...
-Parsing fcidump.37_1ru_II_2pl_noncan_0.2_new.7be1766a-b3f7-4779-9a69-f4358645831b
-Downloading gsee/fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a.gz to fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a.gz...
-Parsing fcidump.13_1_lut_ts_noncan_0.2_new.09c3ddd5-0187-46e8-95c3-157c470cb69a
-Downloading gsee/fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf.gz to fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf.gz...
-Parsing fcidump.14_1_lut_prod_noncan_0.2_new.f36a9dbc-c34a-401f-8ea6-dc996d785edf
-Downloading gsee/fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7.gz to fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7.gz...
-Parsing fcidump.15_1_lut_react_noncan_0.2_new.9cba211b-820c-4ad4-a050-336e8049e1c7
-Downloading gsee/small_molecules/fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb.gz to fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb.gz...
-Parsing fcidump.MnO_vdz.55355f72-52f0-427d-b5ac-3b41666ca5fb
-Downloading gsee/fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea.gz to fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea.gz...
-Parsing fcidump.16_ts_1over4a_noncan_0.2_new.4476d0ff-9618-4774-9619-e3f223249cea
-2024-12-14 17:13:34,465 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:44,782 - INFO - Skipping Logical Resource Estimate because number of orbitals (70) exceeds maximum specified in config (32).
-2024-12-14 17:13:44,783 - INFO - Analyzing task db75bf65-181b-40c2-b978-26453437c2b0...
-2024-12-14 17:13:44,783 - INFO - number of supporting files: 1
-2024-12-14 17:13:44,783 - INFO - supporting data file UUID: f6516937-6182-4dae-a39c-f94c0d72bf70.
-2024-12-14 17:13:44,783 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70.gz.
-2024-12-14 17:13:44,783 - INFO - assuming fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70.gz is an FCIDUMP file.
-2024-12-14 17:13:44,783 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70.gz...
-2024-12-14 17:13:44,787 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:45,417 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:45,431 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:46,000 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:13:50,163 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 17:13:50,163 - INFO - Analyzing task ab482d50-9a85-48d9-aa17-83dcbb38614b...
-2024-12-14 17:13:50,163 - INFO - number of supporting files: 1
-2024-12-14 17:13:50,163 - INFO - supporting data file UUID: 53abfc75-37a3-440c-a023-6e4cbffecd6a.
-2024-12-14 17:13:50,163 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a.gz.
-2024-12-14 17:13:50,163 - INFO - assuming fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a.gz is an FCIDUMP file.
-2024-12-14 17:13:50,163 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a.gz...
-2024-12-14 17:13:50,167 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:13:50,798 - INFO - Authentication (publickey) successful!
-2024-12-14 17:13:50,813 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:13:54,731 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:14:04,394 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 17:14:04,395 - INFO - Analyzing task b628f4be-582f-4f23-96eb-c8b9e0005e4a...
-2024-12-14 17:14:04,395 - INFO - number of supporting files: 1
-2024-12-14 17:14:04,395 - INFO - supporting data file UUID: 3527a125-6e74-4df9-a9ac-ebba7d8b84ff.
-2024-12-14 17:14:04,395 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff.gz.
-2024-12-14 17:14:04,395 - INFO - assuming fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff.gz is an FCIDUMP file.
-2024-12-14 17:14:04,395 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff.gz...
-2024-12-14 17:14:04,400 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:14:05,044 - INFO - Authentication (publickey) successful!
-2024-12-14 17:14:05,062 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:14:05,164 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:14:05,571 - INFO - ===============================================
-2024-12-14 17:14:05,571 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 17:18:25,391 - INFO - Circuit initialization time: 259.81912 seconds.
-2024-12-14 17:18:25,391 - INFO - Estimating logical resources...
-2024-12-14 17:18:56,509 - INFO - Resource estimation time (seconds): 31.118684
-2024-12-14 17:18:56,510 - INFO - Analyzing task c436c481-00d1-49ec-8d0e-0a5e83a8df19...
-2024-12-14 17:18:56,510 - INFO - number of supporting files: 1
-2024-12-14 17:18:56,510 - INFO - supporting data file UUID: 7fc6d81a-8e1c-436f-ade2-93aed1dfee42.
-2024-12-14 17:18:56,510 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42.gz.
-2024-12-14 17:18:56,510 - INFO - assuming fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42.gz is an FCIDUMP file.
-2024-12-14 17:18:56,510 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42.gz...
-2024-12-14 17:18:56,516 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:18:57,152 - INFO - Authentication (publickey) successful!
-2024-12-14 17:18:57,167 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:18:57,431 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:18:59,213 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:18:59,213 - INFO - Analyzing task 349e9cbe-d675-411f-b6b8-be846c27902c...
-2024-12-14 17:18:59,213 - INFO - number of supporting files: 1
-2024-12-14 17:18:59,213 - INFO - supporting data file UUID: 2e1dab84-5b1a-4521-8d36-78117ab88bbd.
-2024-12-14 17:18:59,213 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd.gz.
-2024-12-14 17:18:59,214 - INFO - assuming fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd.gz is an FCIDUMP file.
-2024-12-14 17:18:59,214 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd.gz...
-2024-12-14 17:18:59,218 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:18:59,845 - INFO - Authentication (publickey) successful!
-2024-12-14 17:18:59,860 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:19:00,621 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:19:04,584 - INFO - Skipping Logical Resource Estimate because number of orbitals (55) exceeds maximum specified in config (32).
-2024-12-14 17:19:04,584 - INFO - Analyzing task 3eccbccf-e84a-44b9-b775-cef772cd84f0...
-2024-12-14 17:19:04,585 - INFO - number of supporting files: 1
-2024-12-14 17:19:04,585 - INFO - supporting data file UUID: 21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.
-2024-12-14 17:19:04,585 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.gz.
-2024-12-14 17:19:04,585 - INFO - assuming fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.gz is an FCIDUMP file.
-2024-12-14 17:19:04,585 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.gz...
-2024-12-14 17:19:04,589 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:19:05,247 - INFO - Authentication (publickey) successful!
-2024-12-14 17:19:05,267 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:19:09,259 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:19:18,888 - INFO - Skipping Logical Resource Estimate because number of orbitals (69) exceeds maximum specified in config (32).
-2024-12-14 17:19:18,888 - INFO - Analyzing task 4c240146-6b8b-4fa5-88e4-41cbd39c8ac3...
-2024-12-14 17:19:18,888 - INFO - number of supporting files: 1
-2024-12-14 17:19:18,888 - INFO - supporting data file UUID: b96f67e6-fafe-4ccd-ac6f-67afb52f3835.
-2024-12-14 17:19:18,889 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835.gz.
-2024-12-14 17:19:18,889 - INFO - assuming fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835.gz is an FCIDUMP file.
-2024-12-14 17:19:18,889 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835.gz...
-2024-12-14 17:19:18,894 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:19:19,569 - INFO - Authentication (publickey) successful!
-2024-12-14 17:19:19,586 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:19:19,681 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:19:20,086 - INFO - ===============================================
-2024-12-14 17:19:20,086 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 17:23:50,686 - INFO - Circuit initialization time: 270.59992 seconds.
-2024-12-14 17:23:50,686 - INFO - Estimating logical resources...
-2024-12-14 17:24:29,159 - INFO - Resource estimation time (seconds): 38.472807
-2024-12-14 17:24:29,160 - INFO - Analyzing task c582e543-075c-4fa1-b189-5e7455286d82...
-2024-12-14 17:24:29,160 - INFO - number of supporting files: 1
-2024-12-14 17:24:29,160 - INFO - supporting data file UUID: 47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.
-2024-12-14 17:24:29,160 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.gz.
-2024-12-14 17:24:29,160 - INFO - assuming fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.gz is an FCIDUMP file.
-2024-12-14 17:24:29,160 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.gz...
-2024-12-14 17:24:29,164 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:24:29,790 - INFO - Authentication (publickey) successful!
-2024-12-14 17:24:29,807 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:24:30,007 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:24:31,804 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:24:31,805 - INFO - Analyzing task 3fa3940d-8a68-44ae-9223-7346404651e6...
-2024-12-14 17:24:31,805 - INFO - number of supporting files: 1
-2024-12-14 17:24:31,805 - INFO - supporting data file UUID: bed1771c-394c-44e6-93e3-ca41732326d2.
-2024-12-14 17:24:31,805 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2.gz.
-2024-12-14 17:24:31,805 - INFO - assuming fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2.gz is an FCIDUMP file.
-2024-12-14 17:24:31,805 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2.gz...
-2024-12-14 17:24:31,810 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:24:32,457 - INFO - Authentication (publickey) successful!
-2024-12-14 17:24:32,475 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:24:32,584 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:24:32,995 - INFO - ===============================================
-2024-12-14 17:24:32,995 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 455 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 17:28:55,405 - INFO - Circuit initialization time: 262.410027 seconds.
-2024-12-14 17:28:55,405 - INFO - Estimating logical resources...
-2024-12-14 17:29:32,271 - INFO - Resource estimation time (seconds): 36.865501
-2024-12-14 17:29:32,271 - INFO - Analyzing task eadd62e9-ee3d-4193-94de-7735a529edce...
-2024-12-14 17:29:32,271 - INFO - number of supporting files: 1
-2024-12-14 17:29:32,271 - INFO - supporting data file UUID: 98016425-092d-41a4-b397-9b4b237c582a.
-2024-12-14 17:29:32,271 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a.gz.
-2024-12-14 17:29:32,271 - INFO - assuming fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a.gz is an FCIDUMP file.
-2024-12-14 17:29:32,271 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a.gz...
-2024-12-14 17:29:32,276 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:29:32,958 - INFO - Authentication (publickey) successful!
-2024-12-14 17:29:32,975 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:29:33,560 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:29:35,359 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:29:35,360 - INFO - Analyzing task b900c4a3-fe87-4df7-96b7-2767ccdc1d56...
-2024-12-14 17:29:35,360 - INFO - number of supporting files: 1
-2024-12-14 17:29:35,360 - INFO - supporting data file UUID: e03635b0-a537-4a58-9f3e-c7114715e47d.
-2024-12-14 17:29:35,360 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d.gz.
-2024-12-14 17:29:35,360 - INFO - assuming fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d.gz is an FCIDUMP file.
-2024-12-14 17:29:35,360 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d.gz...
-2024-12-14 17:29:35,365 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:29:36,015 - INFO - Authentication (publickey) successful!
-2024-12-14 17:29:36,220 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:29:36,314 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:29:36,736 - INFO - ===============================================
-2024-12-14 17:29:36,736 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 459 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 460 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 466 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 480 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 481 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:116: UserWarning: Fragment 483 is neither Hermitian or anti-Hermitian!
-  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
-2024-12-14 17:33:57,278 - INFO - Circuit initialization time: 260.542279 seconds.
-2024-12-14 17:33:57,279 - INFO - Estimating logical resources...
-2024-12-14 17:34:35,671 - INFO - Resource estimation time (seconds): 38.392327
-2024-12-14 17:34:35,671 - INFO - Analyzing task 7fc4c1d7-3469-40a3-9cd8-4354b6acf01d...
-2024-12-14 17:34:35,671 - INFO - number of supporting files: 1
-2024-12-14 17:34:35,671 - INFO - supporting data file UUID: f7797f63-30ab-40e0-8ca6-042c9aa932b4.
-2024-12-14 17:34:35,671 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4.gz.
-2024-12-14 17:34:35,671 - INFO - assuming fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4.gz is an FCIDUMP file.
-2024-12-14 17:34:35,671 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4.gz...
-2024-12-14 17:34:35,678 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:34:36,334 - INFO - Authentication (publickey) successful!
-2024-12-14 17:34:36,349 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:34:36,619 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:34:38,408 - INFO - Skipping Logical Resource Estimate because number of orbitals (45) exceeds maximum specified in config (32).
-2024-12-14 17:34:38,409 - INFO - Analyzing task 09b81c3d-aee1-4bc3-98ce-a72da477b108...
-2024-12-14 17:34:38,409 - INFO - number of supporting files: 1
-2024-12-14 17:34:38,409 - INFO - supporting data file UUID: e701d53e-63fe-47f1-b727-39457c9207e6.
-2024-12-14 17:34:38,409 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6.gz.
-2024-12-14 17:34:38,409 - INFO - assuming fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6.gz is an FCIDUMP file.
-2024-12-14 17:34:38,409 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6.gz...
-2024-12-14 17:34:38,414 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:34:39,051 - INFO - Authentication (publickey) successful!
-2024-12-14 17:34:39,068 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:34:39,143 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:34:39,253 - INFO - ===============================================
-2024-12-14 17:34:39,253 - INFO - Calculating Logical Resource Estimate...
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor spin-orbit couplings are not 0. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:154: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
-  obt = get_obt(h1b, spin_orb=spin_orb)
-2024-12-14 17:36:30,409 - INFO - Circuit initialization time: 111.156025 seconds.
-2024-12-14 17:36:30,409 - INFO - Estimating logical resources...
-2024-12-14 17:36:49,078 - INFO - Resource estimation time (seconds): 18.668672
-2024-12-14 17:36:49,078 - INFO - Analyzing task 87d59f7c-e397-42dc-aa6e-00200d8697aa...
-2024-12-14 17:36:49,078 - INFO - number of supporting files: 1
-2024-12-14 17:36:49,078 - INFO - supporting data file UUID: 21abd0b3-b2cb-4a8a-812e-a8706542f429.
-2024-12-14 17:36:49,079 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429.gz.
-2024-12-14 17:36:49,079 - INFO - assuming fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429.gz is an FCIDUMP file.
-2024-12-14 17:36:49,079 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429.gz...
-2024-12-14 17:36:49,085 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:36:49,723 - INFO - Authentication (publickey) successful!
-2024-12-14 17:36:49,739 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:36:49,861 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:36:50,872 - INFO - Skipping Logical Resource Estimate because number of orbitals (39) exceeds maximum specified in config (32).
-2024-12-14 17:36:50,875 - INFO - parsing ../problem_instances/problem_instance.c_o2_0.3987b2dd-25bc-44e2-b516-dbc3f670a9c3.json
-2024-12-14 17:36:50,875 - INFO - problem_instance UUID: 3987b2dd-25bc-44e2-b516-dbc3f670a9c3
-2024-12-14 17:36:50,875 - INFO - problem_instance short name: c_o2_0
-2024-12-14 17:36:50,875 - INFO - contains 2 associated Hamiltonians.
-2024-12-14 17:36:50,890 - INFO - Analyzing task 615c9d78-2b84-4c7b-ab6b-ba05b188f50a...
-2024-12-14 17:36:50,890 - INFO - number of supporting files: 2
-2024-12-14 17:36:50,890 - INFO - supporting data file UUID: b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.
-2024-12-14 17:36:50,891 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.gz.
-2024-12-14 17:36:50,891 - INFO - assuming fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.gz is an FCIDUMP file.
-2024-12-14 17:36:50,891 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.gz...
-2024-12-14 17:36:50,896 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:36:51,554 - INFO - Authentication (publickey) successful!
-2024-12-14 17:36:51,567 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:36:51,705 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:36:52,857 - INFO - Skipping Logical Resource Estimate because number of orbitals (42) exceeds maximum specified in config (32).
-2024-12-14 17:36:52,857 - INFO - supporting data file UUID: 6220544f-c707-41a9-ad9a-40ff8ecd9806.
-2024-12-14 17:36:52,857 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o2_cc-pVDZ.6220544f-c707-41a9-ad9a-40ff8ecd9806.chk.
-2024-12-14 17:36:52,857 - INFO - assuming c_o2_cc-pVDZ.6220544f-c707-41a9-ad9a-40ff8ecd9806.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:36:52,857 - INFO - Analyzing task a091c1a1-bde2-4a83-bf58-5010f7a8e1d4...
-2024-12-14 17:36:52,857 - INFO - number of supporting files: 2
-2024-12-14 17:36:52,857 - INFO - supporting data file UUID: 0ffd2489-0b50-49b6-9e6e-7607f14102a9.
-2024-12-14 17:36:52,858 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9.gz.
-2024-12-14 17:36:52,858 - INFO - assuming fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9.gz is an FCIDUMP file.
-2024-12-14 17:36:52,858 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9.gz...
-2024-12-14 17:36:52,863 - INFO - Connected (version 2.0, client 0)
-2024-12-14 17:36:53,507 - INFO - Authentication (publickey) successful!
-2024-12-14 17:36:53,523 - INFO - [chan 0] Opened sftp connection (server version 3)
-2024-12-14 17:37:06,585 - INFO - [chan 0] sftp session closed.
-2024-12-14 17:37:24,227 - INFO - Skipping Logical Resource Estimate because number of orbitals (90) exceeds maximum specified in config (32).
-2024-12-14 17:37:24,227 - INFO - supporting data file UUID: b7c6b59b-435b-47e0-8f7b-d2e3b5573437.
-2024-12-14 17:37:24,228 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/c_o2_cc-pVTZ.b7c6b59b-435b-47e0-8f7b-d2e3b5573437.chk.
-2024-12-14 17:37:24,228 - INFO - assuming c_o2_cc-pVTZ.b7c6b59b-435b-47e0-8f7b-d2e3b5573437.chk is NOT an FCIDUMP file.  SKIPPING!
-2024-12-14 17:37:24,232 - INFO - done.
-2024-12-14 17:37:24,232 - INFO - overall start time: 2024-12-14 13:38:56.164564
-2024-12-14 17:37:24,232 - INFO - overall stop time: 2024-12-14 17:37:24.232529
-2024-12-14 17:37:24,232 - INFO - run time (seconds): 14308.067965
-Downloading gsee/fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab.gz to fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab.gz...
-Parsing fcidump.17_ts_1over4a_noncan_0.2_new.d74d0c01-8507-445b-bec1-f02bafbbfaab
-Downloading gsee/fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70.gz to fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70.gz...
-Parsing fcidump.18_I_noncan_0.2_new.f6516937-6182-4dae-a39c-f94c0d72bf70
-Downloading gsee/fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a.gz to fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a.gz...
-Parsing fcidump.19_I_noncan_0.2_new.53abfc75-37a3-440c-a023-6e4cbffecd6a
-Downloading gsee/fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff.gz to fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff.gz...
-Parsing fcidump.20_rc_noncan_0.2_new.3527a125-6e74-4df9-a9ac-ebba7d8b84ff
-Downloading gsee/fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42.gz to fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42.gz...
-Parsing fcidump.21_rc_noncan_0.2_new.7fc6d81a-8e1c-436f-ade2-93aed1dfee42
-Downloading gsee/fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd.gz to fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd.gz...
-Parsing fcidump.22_pc-_noncan_0.2_new.2e1dab84-5b1a-4521-8d36-78117ab88bbd
-Downloading gsee/fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.gz to fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee.gz...
-Parsing fcidump.23_pc-_noncan_0.2_new.21b0efe8-adc7-44c2-ac49-671cc4b4a1ee
-Downloading gsee/fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835.gz to fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835.gz...
-Parsing fcidump.24_ts_1over2_noncan_0.2_new.b96f67e6-fafe-4ccd-ac6f-67afb52f3835
-Downloading gsee/fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.gz to fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4.gz...
-Parsing fcidump.25_ts_1over2_noncan_0.2_new.47f67a0f-a385-405d-9ac6-2e22f8ceb8e4
-Downloading gsee/fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2.gz to fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2.gz...
-Parsing fcidump.26_pc_noncan_0.2_new.bed1771c-394c-44e6-93e3-ca41732326d2
-Downloading gsee/fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a.gz to fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a.gz...
-Parsing fcidump.27_pc_noncan_0.2_new.98016425-092d-41a4-b397-9b4b237c582a
-Downloading gsee/fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d.gz to fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d.gz...
-Parsing fcidump.28_2_noncan_0.2_new.e03635b0-a537-4a58-9f3e-c7114715e47d
-Downloading gsee/fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4.gz to fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4.gz...
-Parsing fcidump.29_2_noncan_0.2_new.f7797f63-30ab-40e0-8ca6-042c9aa932b4
-Downloading gsee/fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6.gz to fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6.gz...
-Parsing fcidump.30_4a_noncan_0.2_new.e701d53e-63fe-47f1-b727-39457c9207e6
-Downloading gsee/fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429.gz to fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429.gz...
-Parsing fcidump.31_4a_noncan_0.2_new.21abd0b3-b2cb-4a8a-812e-a8706542f429
-Downloading gsee/small_molecules/fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.gz to fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5.gz...
-Parsing fcidump.c_o2_cc-pVDZ.b45cfaee-dd16-4f80-963d-ab0f9cc4dab5
-Downloading gsee/small_molecules/fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9.gz to fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9.gz...
-Parsing fcidump.c_o2_cc-pVTZ.0ffd2489-0b50-49b6-9e6e-7607f14102a9
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diff --git a/scripts/testing_LRE/README.md b/scripts/testing_LRE/README.md
new file mode 100644
index 0000000..d26732e
--- /dev/null
+++ b/scripts/testing_LRE/README.md
@@ -0,0 +1,22 @@
+notes:
+
+Test run setting `LRE_config_overlaps.json` parameter  `max_orbitals` to 1000 (more than we need.)  Calculation started over the largest problem instance (below).  Calculation ran for over a day and errored out.
+
+
+Problem instance "Sc_1" as 3 tasks
+
+task UUID, num_orbitals
+
+10119019-eea2-45c9-a748-e206780c4235,   135 orbitals, we have overlap
+ca6f7678-0952-4fe4-83fe-c4455a682132,   54 orbitals, we have overlap
+78d5e5ba-0b2c-4cfe-92c5-f1c749150015,   88  orbitals, we have overlap
+
+
+testing call:
+
+nohup ./compute_all_LREs_script.py -i ./testing_LRE/problem_instances/ -o ./testing_LRE/temp_LRE_solution_files/ --LRE_config_file LRE_config_overlaps.json --sftp_username darpa-qb --sftp_key_file ~/.ssh/darpa-qb-key.ppk &
+
+
+
+
+
diff --git a/scripts/testing_LRE/compute_all_LREs_scripts.log.txt b/scripts/testing_LRE/compute_all_LREs_scripts.log.txt
new file mode 100644
index 0000000..e35fb9b
--- /dev/null
+++ b/scripts/testing_LRE/compute_all_LREs_scripts.log.txt
@@ -0,0 +1,42 @@
+  
+2024-12-17 08:17:17,609 - INFO - ===============================================
+2024-12-17 08:17:17,610 - INFO - overall start time: 2024-12-17 08:17:17.609939
+2024-12-17 08:17:17,610 - INFO - input directory: ./testing_LRE/problem_instances/
+2024-12-17 08:17:17,610 - INFO - parsing 1 files in the input directory
+2024-12-17 08:17:17,610 - INFO - file: problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
+2024-12-17 08:17:17,611 - INFO - parsing 0 files in the output directory
+2024-12-17 08:17:17,611 - INFO - found 0 existing solutions for this solver.
+2024-12-17 08:17:17,611 - INFO - parsing ./testing_LRE/problem_instances/problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
+2024-12-17 08:17:17,611 - INFO - problem_instance UUID: c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7
+2024-12-17 08:17:17,611 - INFO - problem_instance short name: Sc_1
+2024-12-17 08:17:17,612 - INFO - contains 3 associated Hamiltonians.
+2024-12-17 08:17:17,628 - INFO - Analyzing task ca6f7678-0952-4fe4-83fe-c4455a682132...
+2024-12-17 08:17:17,628 - INFO - number of supporting files: 2
+2024-12-17 08:17:17,628 - INFO - supporting data file UUID: 75228927-fac3-4caf-9e09-1fdfe51098a3.
+2024-12-17 08:17:17,628 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz.
+2024-12-17 08:17:17,629 - INFO - assuming fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz is an FCIDUMP file.
+2024-12-17 08:17:17,629 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz...
+2024-12-17 08:17:17,636 - INFO - Connected (version 2.0, client 0)
+2024-12-17 08:17:18,278 - INFO - Authentication (publickey) successful!
+2024-12-17 08:17:18,291 - INFO - [chan 0] Opened sftp connection (server version 3)
+2024-12-17 08:17:18,486 - INFO - [chan 0] sftp session closed.
+2024-12-17 08:17:20,358 - INFO - ===============================================
+2024-12-17 08:17:20,358 - INFO - Calculating Logical Resource Estimate...
+2024-12-17 08:39:05,694 - INFO - Circuit initialization time: 1305.335335 seconds.
+2024-12-17 08:39:05,694 - INFO - Estimating logical resources...
+2024-12-17 08:47:34,506 - INFO - Resource estimation time (seconds): 508.811682
+2024-12-17 08:47:34,506 - INFO - supporting data file UUID: 5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.
+2024-12-17 08:47:34,506 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk.
+2024-12-17 08:47:34,506 - INFO - assuming Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk is NOT an FCIDUMP file.  SKIPPING!
+2024-12-17 08:47:34,506 - INFO - Analyzing task 10119019-eea2-45c9-a748-e206780c4235...
+2024-12-17 08:47:34,506 - INFO - number of supporting files: 2
+2024-12-17 08:47:34,507 - INFO - supporting data file UUID: cfc29172-5c9c-4e13-9a31-17895ed89c95.
+2024-12-17 08:47:34,507 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz.
+2024-12-17 08:47:34,507 - INFO - assuming fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz is an FCIDUMP file.
+2024-12-17 08:47:34,507 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz...
+2024-12-17 08:47:34,512 - INFO - Connected (version 2.0, client 0)
+2024-12-17 08:47:34,991 - INFO - Authentication (publickey) successful!
+2024-12-17 08:47:35,006 - INFO - [chan 0] Opened sftp connection (server version 3)
+2024-12-17 08:49:59,649 - INFO - [chan 0] sftp session closed.
+2024-12-17 08:51:04,187 - INFO - ===============================================
+2024-12-17 08:51:04,187 - INFO - Calculating Logical Resource Estimate...
diff --git a/scripts/testing_LRE/nohup.out b/scripts/testing_LRE/nohup.out
new file mode 100644
index 0000000..9899634
--- /dev/null
+++ b/scripts/testing_LRE/nohup.out
@@ -0,0 +1,257 @@
+  
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/cotengra/hyperoptimizers/hyper.py:33: UserWarning: Couldn't import `kahypar` - skipping from default hyper optimizer and using basic `labels` method instead.
+  warnings.warn(
+2024-12-17 08:17:17,609 - INFO - ===============================================
+2024-12-17 08:17:17,610 - INFO - overall start time: 2024-12-17 08:17:17.609939
+2024-12-17 08:17:17,610 - INFO - input directory: ./testing_LRE/problem_instances/
+2024-12-17 08:17:17,610 - INFO - parsing 1 files in the input directory
+2024-12-17 08:17:17,610 - INFO - file: problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
+2024-12-17 08:17:17,611 - INFO - parsing 0 files in the output directory
+2024-12-17 08:17:17,611 - INFO - found 0 existing solutions for this solver.
+2024-12-17 08:17:17,611 - INFO - parsing ./testing_LRE/problem_instances/problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
+2024-12-17 08:17:17,611 - INFO - problem_instance UUID: c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7
+2024-12-17 08:17:17,611 - INFO - problem_instance short name: Sc_1
+2024-12-17 08:17:17,612 - INFO - contains 3 associated Hamiltonians.
+2024-12-17 08:17:17,628 - INFO - Analyzing task ca6f7678-0952-4fe4-83fe-c4455a682132...
+2024-12-17 08:17:17,628 - INFO - number of supporting files: 2
+2024-12-17 08:17:17,628 - INFO - supporting data file UUID: 75228927-fac3-4caf-9e09-1fdfe51098a3.
+2024-12-17 08:17:17,628 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz.
+2024-12-17 08:17:17,629 - INFO - assuming fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz is an FCIDUMP file.
+2024-12-17 08:17:17,629 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz...
+2024-12-17 08:17:17,636 - INFO - Connected (version 2.0, client 0)
+2024-12-17 08:17:18,278 - INFO - Authentication (publickey) successful!
+2024-12-17 08:17:18,291 - INFO - [chan 0] Opened sftp connection (server version 3)
+2024-12-17 08:17:18,486 - INFO - [chan 0] sftp session closed.
+2024-12-17 08:17:20,358 - INFO - ===============================================
+2024-12-17 08:17:20,358 - INFO - Calculating Logical Resource Estimate...
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:166: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
+  obt = get_obt(h1b, spin_orb=spin_orb)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 691 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 698 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 708 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 713 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 714 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 715 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 716 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 717 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 720 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 729 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 730 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 731 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 732 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 733 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 734 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 739 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 740 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 741 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 742 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 744 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 746 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 747 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 748 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 749 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 750 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 751 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 752 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 753 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 754 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 755 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 756 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 757 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 758 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 759 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 760 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 761 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 762 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 763 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 764 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 765 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 766 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 767 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 768 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 769 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 770 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 771 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 772 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 773 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 774 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 775 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 776 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 777 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 778 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 779 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 780 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 781 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 782 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 783 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 784 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 785 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 786 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 787 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 788 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 789 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 790 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 791 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 792 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 793 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 794 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 795 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 796 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 797 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 798 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 799 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 800 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 801 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 802 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 803 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 804 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py:130: UserWarning: Fragment 805 is neither Hermitian or anti-Hermitian!
+  return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:193: RuntimeWarning: divide by zero encountered in scalar divide
+  ccur = coeffs[i] / np.prod(np.sin(2 * thetas[0:i-1]))
+2024-12-17 08:39:05,694 - INFO - Circuit initialization time: 1305.335335 seconds.
+2024-12-17 08:39:05,694 - INFO - Estimating logical resources...
+2024-12-17 08:47:34,506 - INFO - Resource estimation time (seconds): 508.811682
+2024-12-17 08:47:34,506 - INFO - supporting data file UUID: 5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.
+2024-12-17 08:47:34,506 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk.
+2024-12-17 08:47:34,506 - INFO - assuming Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk is NOT an FCIDUMP file.  SKIPPING!
+2024-12-17 08:47:34,506 - INFO - Analyzing task 10119019-eea2-45c9-a748-e206780c4235...
+2024-12-17 08:47:34,506 - INFO - number of supporting files: 2
+2024-12-17 08:47:34,507 - INFO - supporting data file UUID: cfc29172-5c9c-4e13-9a31-17895ed89c95.
+2024-12-17 08:47:34,507 - INFO - supporting data file URL: sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz.
+2024-12-17 08:47:34,507 - INFO - assuming fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz is an FCIDUMP file.
+2024-12-17 08:47:34,507 - INFO - SFTP downloading file sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz...
+2024-12-17 08:47:34,512 - INFO - Connected (version 2.0, client 0)
+2024-12-17 08:47:34,991 - INFO - Authentication (publickey) successful!
+2024-12-17 08:47:35,006 - INFO - [chan 0] Opened sftp connection (server version 3)
+2024-12-17 08:49:59,649 - INFO - [chan 0] sftp session closed.
+2024-12-17 08:51:04,187 - INFO - ===============================================
+2024-12-17 08:51:04,187 - INFO - Calculating Logical Resource Estimate...
+/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py:166: UserWarning: one-body tensor isn't symmetric to spin-flips. This should not affect the DoubleFactorized resource estimates.
+  obt = get_obt(h1b, spin_orb=spin_orb)
+./testing_LRE/temp_LRE_solution_files/
+[]
+Downloading gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz to fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz...
+Parsing fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3
+Detected IPython. Loading juliacall extension. See https://juliapy.github.io/PythonCall.jl/stable/compat/#IPython
+Downloading gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz to fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz...
+Parsing fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95
+Traceback (most recent call last):
+  File "/home/labuser/Projects/qb-gsee-benchmark/scripts/./compute_all_LREs_script.py", line 358, in <module>
+    main(args)
+  File "/home/labuser/Projects/qb-gsee-benchmark/scripts/./compute_all_LREs_script.py", line 291, in main
+    resource_estimate = get_lqre(
+  File "/home/labuser/Projects/qb-gsee-benchmark/scripts/./compute_all_LREs_script.py", line 140, in get_lqre
+    ) = get_df_qpe_circuit(
+  File "/home/labuser/Projects/qb-gsee-benchmark/src/qb_gsee_benchmark/qre.py", line 152, in get_df_qpe_circuit
+    encoding = DoubleFactorized(
+  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/BlockEncodings/DoubleFactorized.py", line 67, in __init__
+    one_body_array, two_body_array, self.Xi_l_data, self.givens_angle_tensor = self.PI.yield_DF_Info(df_error_threshold=df_error_threshold,sf_error_threshold=sf_error_threshold)
+  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py", line 193, in yield_DF_Info
+    DF_frags = self.DF_fragments(sf_error_threshold)
+  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/ProblemInstances/ChemicalHamiltonian.py", line 130, in DF_fragments
+    return DF_decomposition(h0, one_body_tensor, two_body_tensor,tol=sf_error_threshold)
+  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/pyLIQTR/utils/df_utils.py", line 254, in DF_decomposition
+    wl, Ul = np.linalg.eigh(cur_l)
+  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/numpy/linalg/linalg.py", line 1487, in eigh
+    w, vt = gufunc(a, signature=signature, extobj=extobj)
+  File "/home/labuser/Projects/qb-gsee-benchmark/.venv/lib/python3.10/site-packages/numpy/linalg/linalg.py", line 118, in _raise_linalgerror_eigenvalues_nonconvergence
+    raise LinAlgError("Eigenvalues did not converge")
+numpy.linalg.LinAlgError: Eigenvalues did not converge
+   Resolving package versions...
+  No Changes to `~/Projects/qb-gsee-benchmark/.venv/julia_env/Project.toml`
+  No Changes to `~/Projects/qb-gsee-benchmark/.venv/julia_env/Manifest.toml`
+Precompiling project...
+  ✗ MathOptInterface
+  ✓ Optim → OptimMOIExt
+  ✓ Ipopt
+  ✓ JuMP
+  ✓ HiGHS
+  ✓ QuantumMAMBO
+  5 dependencies successfully precompiled in 275 seconds. 100 already precompiled.
+  1 dependency errored. To see a full report either run `import Pkg; Pkg.precompile()` or load the package
+   Resolving package versions...
+  No Changes to `~/Projects/qb-gsee-benchmark/.venv/julia_env/Project.toml`
+  No Changes to `~/Projects/qb-gsee-benchmark/.venv/julia_env/Manifest.toml`
+   Resolving package versions...
+  No Changes to `~/Projects/qb-gsee-benchmark/.venv/julia_env/Project.toml`
+  No Changes to `~/Projects/qb-gsee-benchmark/.venv/julia_env/Manifest.toml`
diff --git a/scripts/testing_LRE/problem_instances/problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json b/scripts/testing_LRE/problem_instances/problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
new file mode 100644
index 0000000..325db93
--- /dev/null
+++ b/scripts/testing_LRE/problem_instances/problem_instance.Sc_1.c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7.json
@@ -0,0 +1,148 @@
+{
+    "$schema": "https://raw.githubusercontent.com/isi-usc-edu/qb-gsee-benchmark/main/schemas/problem_instance.schema.0.0.1.json",
+    "references": [
+        "https://doi.org/10.1103/PhysRevX.10.011041"
+    ],
+    "problem_instance_uuid": "c6ab4ddb-efe8-46d6-9fc4-90901c08d9a7",
+    "creation_timestamp": "2024-11-20T00:35:04.859052",
+    "calendar_due_date": null,
+    "short_name": "Sc_1",
+    "license": {
+        "name": "Apache 2.0",
+        "url": "http://www.apache.org/licenses/LICENSE-2.0"
+    },
+    "contact_info": [
+        {
+            "name": "Matthew Otten",
+            "email": "mjotten@wisc.edu",
+            "institution": "University of Wisconsin -- Madison"
+        },
+        {
+            "name": "Thomas Watts",
+            "email": "-",
+            "institution": "HRL Laboratories"
+        },
+        {
+            "name": "Joshua T. Cantin",
+            "email": "joshua.cantin@utoronto.ca",
+            "institution": "University of Toronto at Scarborough"
+        }
+    ],
+    "status": "in_development",
+    "superseded_by": null,
+    "problem_type": "GSEE",
+    "application_domain": "QC",
+    "tasks": [
+        {
+            "task_uuid": "ca6f7678-0952-4fe4-83fe-c4455a682132",
+            "features": {
+                "molecule_name": "Sc1_vdz",
+                "geometry": "Sc          0.00000        0.00000        0.00000",
+                "basis_set": "vdz",
+                "charge": 1,
+                "multiplicity": 3,
+                "num_electrons": 10,
+                "num_orbitals": 54
+            },
+            "requirements": {
+                "probability_of_success": 0.99,
+                "time_limit_seconds": 86400,
+                "accuracy": 1.0,
+                "energy_units": "millihartree",
+                "energy_target": 0.99,
+                "reference_energy": -46.15683,
+                "reference_energy_units": "hartree",
+                "reference_energy_source": "https://doi.org/10.1103/PhysRevX.10.011041",
+                "reference_energy_method": "SHCI"
+            },
+            "supporting_files": [
+                {
+                    "instance_data_object_uuid": "75228927-fac3-4caf-9e09-1fdfe51098a3",
+                    "instance_data_object_url": "sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vdz.75228927-fac3-4caf-9e09-1fdfe51098a3.gz",
+                    "instance_data_checksum": "7c10446e77feed269009bdb39b415f29c9ed23b1",
+                    "instance_data_checksum_type": "sha1sum"
+                },
+                {
+                    "instance_data_object_uuid": "5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f",
+                    "instance_data_object_url": "sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vdz.5fc63d72-8bd6-41c6-aaa2-2fbbcea4029f.chk",
+                    "instance_data_checksum": "0e486aeafb35cace7e4f894ea31194e96d93b255",
+                    "instance_data_checksum_type": "sha1sum"
+                }
+            ]
+        },
+        {
+            "task_uuid": "10119019-eea2-45c9-a748-e206780c4235",
+            "features": {
+                "molecule_name": "Sc1_vqz",
+                "geometry": "Sc          0.00000        0.00000        0.00000",
+                "basis_set": "vqz",
+                "charge": 1,
+                "multiplicity": 3,
+                "num_electrons": 10,
+                "num_orbitals": 135
+            },
+            "requirements": {
+                "probability_of_success": 0.99,
+                "time_limit_seconds": 86400,
+                "accuracy": 1.0,
+                "energy_units": "millihartree",
+                "energy_target": 0.99,
+                "reference_energy": -46.23311,
+                "reference_energy_units": "hartree",
+                "reference_energy_source": "https://doi.org/10.1103/PhysRevX.10.011041",
+                "reference_energy_method": "SHCI"
+            },
+            "supporting_files": [
+                {
+                    "instance_data_object_uuid": "cfc29172-5c9c-4e13-9a31-17895ed89c95",
+                    "instance_data_object_url": "sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vqz.cfc29172-5c9c-4e13-9a31-17895ed89c95.gz",
+                    "instance_data_checksum": "735a06287ac26f437570940721022953c8fe3bb8",
+                    "instance_data_checksum_type": "sha1sum"
+                },
+                {
+                    "instance_data_object_uuid": "49ba78c1-9c90-45ed-afe8-56cf76b89697",
+                    "instance_data_object_url": "sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vqz.49ba78c1-9c90-45ed-afe8-56cf76b89697.chk",
+                    "instance_data_checksum": "7c0b5d35c166deba717f575428fe557ab77077fa",
+                    "instance_data_checksum_type": "sha1sum"
+                }
+            ]
+        },
+        {
+            "task_uuid": "78d5e5ba-0b2c-4cfe-92c5-f1c749150015",
+            "features": {
+                "molecule_name": "Sc1_vtz",
+                "geometry": "Sc          0.00000        0.00000        0.00000",
+                "basis_set": "vtz",
+                "charge": 1,
+                "multiplicity": 3,
+                "num_electrons": 10,
+                "num_orbitals": 88
+            },
+            "requirements": {
+                "probability_of_success": 0.99,
+                "time_limit_seconds": 86400,
+                "accuracy": 1.0,
+                "energy_units": "millihartree",
+                "energy_target": 0.99,
+                "reference_energy": -46.21149000000001,
+                "reference_energy_units": "hartree",
+                "reference_energy_source": "https://doi.org/10.1103/PhysRevX.10.011041",
+                "reference_energy_method": "SHCI"
+            },
+            "supporting_files": [
+                {
+                    "instance_data_object_uuid": "adfdddd9-6ebe-4661-8bd8-c8810f117a6a",
+                    "instance_data_object_url": "sftp://sftp.l3harris.com/gsee/small_molecules/fcidump.Sc1_vtz.adfdddd9-6ebe-4661-8bd8-c8810f117a6a.gz",
+                    "instance_data_checksum": "cd48f40d6fc50ad3233eaf80465f4888ca4057f1",
+                    "instance_data_checksum_type": "sha1sum"
+                },
+                {
+                    "instance_data_object_uuid": "01a9aae3-1545-469e-8816-eda173836278",
+                    "instance_data_object_url": "sftp://sftp.l3harris.com/gsee/small_molecules/Sc1_vtz.01a9aae3-1545-469e-8816-eda173836278.chk",
+                    "instance_data_checksum": "c34d55c2b26e439dd86d49317c4759c8a1b9305c",
+                    "instance_data_checksum_type": "sha1sum"
+                }
+            ]
+        }
+    ]
+}
\ No newline at end of file