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Analyzed about 6 hours ago. based on code collected about 20 hours ago.

Commit Message	Contributor	Files Modified	Lines Added	Lines Removed	Code Location	Date
May 02, 2023 — May 02, 2024 Showing page 2 of 195 Search / Filter on:
See https://github.com/cclib/cclib/commit/0b32d81f7898129f4888f4a5ce873de197932ed7 from refs/heads/master	cclib	More...				5 days ago
Merge pull request #1411 from berquist/fix-docs-push	Eric Berquist	More...				5 days ago
docs push requires secret inheritance	Eric Berquist	More...				5 days ago
Merge pull request #1410 from berquist/fix-docs-push	Eric Berquist	More...				7 days ago
docs: build cclib during checkout to autogen version file	Eric Berquist	More...				7 days ago
sphinx_rtd_theme already in base image	Eric Berquist	More...				7 days ago
build docs on every push and PR	Eric Berquist	More...				7 days ago
QChem: clean up parsing entropy	Eric Berquist	More...				7 days ago
QChem: fix parsing enthalpy	Eric Berquist	More...				7 days ago
Jaguar: implement entropy, enthalpy, and freeenergy	Eric Berquist	More...				7 days ago
GAMESS: clean up setting enthalpy and freeenergy	Eric Berquist	More...				7 days ago
testSP: unify SCF and MO energies; fix energy units in regressions	Eric Berquist	More...				7 days ago
Psi4: combine successful termination conditions	Eric Berquist	More...				7 days ago
NWChem: silence skip_lines warning	Eric Berquist	More...				7 days ago
NWChem: remove unnecessary utils.float	Eric Berquist	More...				7 days ago
compute freeenergy if not present and required attributes are available	Eric Berquist	More...				7 days ago
ADF: temperature-dependent entropy	Eric Berquist	More...				8 days ago
ORCA: set_attribute in thermochemistry section	Eric Berquist	More...				8 days ago
Psi4: append_attribute in vibrational section	Eric Berquist	More...				8 days ago
ADF: set unknown core MO energies to NaN	Eric Berquist	More...				8 days ago
Update classes needed as part of https://github.com/cclib/cclib/pull/1405	Eric Berquist	More...				8 days ago
Merge pull request #1406 from cclib/pre-commit-ci-update-config	Eric Berquist	More...				8 days ago
[pre-commit.ci] pre-commit autoupdate	pre-commit-ci[bot]	More...				10 days ago
refactor thermochemistry tests in order to ease unit transition	Eric Berquist	More...				21 days ago
ORCA: type annotations for energy_intensity	Eric Berquist	More...				21 days ago
ORCA: fix parsing EOM-CCSD energy into atomic units	Eric Berquist	More...				21 days ago
update ccData docstring	Eric Berquist	More...				21 days ago
Merge pull request #1408 from berquist/1401-metadata-success	Eric Berquist	More...				22 days ago
update codecov GitHub action	Eric Berquist	More...				22 days ago
metadata: implement success for Molcas and Psi3	Eric Berquist	More...				22 days ago

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