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Commits : Listings

Analyzed about 12 hours ago. based on code collected 1 day ago.
Apr 18, 2023 — Apr 18, 2024
Commit Message Contributor Files Modified Lines Added Lines Removed Code Location Date
Merge pull request #1408 from berquist/1401-metadata-success
Eric Berquist
More... 9 days ago
update codecov GitHub action
Eric Berquist
More... 9 days ago
metadata: implement success for Molcas and Psi3
Eric Berquist
More... 9 days ago
Merge pull request #188 from berquist/1401-metadata-success
Eric Berquist
More... 9 days ago
FChk: add parent unconverged outputs that don't need testing themselves
Eric Berquist
More... 9 days ago
FChk: improve regression tests looking at success tag
Eric Berquist
More... 9 days ago
FChk: printing for unknown jobtype
Eric Berquist
More... 9 days ago
FChk: add outputs from unconverged calculations
Eric Berquist
More... 9 days ago
FChk: start program-dependent setting of success flag
Eric Berquist
More... 10 days ago
Merge pull request #187 from cclib/pre-commit-ci-update-config
Eric Berquist
More... 11 days ago
[pre-commit.ci] pre-commit autoupdate
pre-commit-ci[bot]
More... 11 days ago
Merge pull request #1404 from berquist/optdone-as-list-now-default
Eric Berquist
More... 14 days ago
update optdone documentation
Eric Berquist
More... 14 days ago
split optdone and geo convergence tests; look for list of int
Eric Berquist
More... 14 days ago
DALTON: fix optdone list
Eric Berquist
More... 14 days ago
Merge pull request #1403 from berquist/update-readme-for-2.0-development
Eric Berquist
More... 14 days ago
update readme for 2.0 development
Eric Berquist
More... 14 days ago
metadata: test for success flag on SP
Eric Berquist
More... 14 days ago
MOPAC: fix detecting successful termination
Eric Berquist
More... 15 days ago
metadata: test for success flag on SP
Eric Berquist
More... 15 days ago
FChk: set metadata success for Gaussian 16
Eric Berquist
More... 15 days ago
metadata: default to not setting success at all
Eric Berquist
More... 15 days ago
chmod 644 data/FChk/basicQChem5.2/*
Eric Berquist
More... 15 days ago
update some file extensions from .FChk to .fchk
Eric Berquist
More... 15 days ago
Merge pull request #1400 from cclib/pre-commit-ci-update-config
Eric Berquist
More... 18 days ago
[pre-commit.ci] pre-commit autoupdate
pre-commit-ci[bot]
More... 18 days ago
Merge pull request #1398 from cclib/pre-commit-ci-update-config
Eric Berquist
More... 25 days ago
[pre-commit.ci] pre-commit autoupdate
pre-commit-ci[bot]
More... 25 days ago
Merge pull request #1391 from cclib/pre-commit-ci-update-config
Eric Berquist
More... about 1 month ago
Merge pull request #1390 from cclib/release-1.8.1-merge
Eric Berquist
More... about 1 month ago