Allow calculating the democratically parititoned energy when using MPI #166
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Codecov ReportAttention: Patch coverage is
Additional details and impacted files@@ Coverage Diff @@
## master #166 +/- ##
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Coverage 0.00% 0.00%
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Files 156 156
Lines 20797 20807 +10
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- Misses 20797 20807 +10 ☔ View full report in Codecov by Sentry. |
ghb24
reviewed
Apr 24, 2024
| @@ -1263,7 +1263,7 @@ def make_rdm1_demo(self, *args, **kwargs): | |||
| def make_rdm2_demo(self, *args, **kwargs): | |||
| return make_rdm2_demo_rhf(self, *args, **kwargs) | |||
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| def get_dmet_elec_energy(self, part_cumulant=True, approx_cumulant=True): | |||
| def get_dmet_elec_energy(self, part_cumulant=True, approx_cumulant=True, mpi_target=None): | |||
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Include description of mpi_target in the docstring.
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