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v0.28 changelog
Lint #1032: Pull request #422 synchronize by loriab
August 12, 2023 16:46 29s loriab:changelog_28
August 12, 2023 16:46 29s
Save parallel set up for MRChem in provenance (#388)
Lint #1031: Commit eb3366f pushed by loriab
August 12, 2023 16:38 32s master
August 12, 2023 16:38 32s
overhaul psi4 detection parsing
Lint #1030: Pull request #418 synchronize by loriab
August 12, 2023 02:13 31s loriab:psifoundagain
August 12, 2023 02:13 31s
SVWN reference Hessians
Lint #1029: Pull request #424 opened by loriab
August 11, 2023 05:18 36s loriab:svwn_refs
August 11, 2023 05:18 36s
v0.28 changelog
Lint #1028: Pull request #422 synchronize by loriab
August 10, 2023 16:06 37s loriab:changelog_28
August 10, 2023 16:06 37s
update gCP levels and extend D4 defaults (#393)
Lint #1027: Commit 8c9f0ab pushed by loriab
August 10, 2023 15:11 41s master
August 10, 2023 15:11 41s
update gCP levels and extend D4 defaults
Lint #1026: Pull request #393 synchronize by loriab
August 10, 2023 07:50 31s hokru:3cupdate
August 10, 2023 07:50 31s
update gCP levels and extend D4 defaults
Lint #1025: Pull request #393 synchronize by loriab
August 10, 2023 07:32 35s hokru:3cupdate
August 10, 2023 07:32 35s
update gCP levels and extend D4 defaults
Lint #1024: Pull request #393 synchronize by loriab
August 10, 2023 07:31 39s hokru:3cupdate
August 10, 2023 07:31 39s
update gCP levels and extend D4 defaults
Lint #1023: Pull request #393 synchronize by loriab
August 10, 2023 05:09 32s hokru:3cupdate
August 10, 2023 05:09 32s
update gCP levels and extend D4 defaults
Lint #1022: Pull request #393 synchronize by loriab
August 8, 2023 21:40 32s hokru:3cupdate
August 8, 2023 21:40 32s
cleanup: known test fault, codeql
Lint #1021: Pull request #423 opened by loriab
August 8, 2023 21:33 36s loriab:codeqlfixes
August 8, 2023 21:33 36s
v0.28 changelog
Lint #1020: Pull request #422 opened by loriab
August 8, 2023 17:19 32s loriab:changelog_28
August 8, 2023 17:19 32s
Fix MDI forces structure (#401)
Lint #1019: Commit 5935117 pushed by loriab
August 8, 2023 16:49 30s master
August 8, 2023 16:49 30s
overhaul psi4 detection parsing
Lint #1018: Pull request #418 synchronize by loriab
August 8, 2023 16:44 27s loriab:psifoundagain
August 8, 2023 16:44 27s
overhaul psi4 detection parsing
Lint #1017: Pull request #418 synchronize by loriab
August 8, 2023 16:32 32s loriab:psifoundagain
August 8, 2023 16:32 32s
gamess memory changes
Lint #1016: Pull request #421 opened by loriab
August 8, 2023 07:08 29s loriab:taylor_gamess_mem
August 8, 2023 07:08 29s
Fix MDI forces structure
Lint #1015: Pull request #401 synchronize by loriab
August 8, 2023 06:59 31s taylor-a-barnes:mdi
August 8, 2023 06:59 31s
defer MPI in MDI
Lint #1014: Pull request #420 opened by loriab
August 8, 2023 06:44 39s loriab:mdimpifix
August 8, 2023 06:44 39s
Add CodeQL workflow for GitHub code scanning (#386)
Lint #1013: Commit 034fd1a pushed by loriab
August 8, 2023 02:38 29s master
August 8, 2023 02:38 29s
Add CodeQL workflow for GitHub code scanning
Lint #1012: Pull request #386 synchronize by loriab
August 8, 2023 02:08 36s lgtm-migrator:codeql
August 8, 2023 02:08 36s
update badges and remove lgtm (#419)
Lint #1011: Commit 4648007 pushed by loriab
August 8, 2023 02:06 35s master
August 8, 2023 02:06 35s
update badges and remove lgtm
Lint #1010: Pull request #419 opened by loriab
August 8, 2023 02:00 31s loriab:tidying
August 8, 2023 02:00 31s
Allow specifying task config via environment and CLI (#400)
Lint #1009: Commit e5a43ba pushed by loriab
August 7, 2023 23:29 32s master
August 7, 2023 23:29 32s
Allow specifying task config via environment and CLI
Lint #1008: Pull request #400 synchronize by loriab
August 7, 2023 22:29 37s more_task_config
August 7, 2023 22:29 37s