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Commits on Oct 28, 2026
- Bump to version 4.3.1 (#414)
  awvwgk
  authored
  1107ea7
- CMake: Cleanup custom-lapack support (#408)
  Growl1234
  authored
  c2b1bcd
Commits on Oct 27, 2026
- update dependencies (#413)
  thfroitzheim
  authored
  96824db
- Keep PySCF dispersion molecules consistent during reset (#412)
  
  Copilot
  and
  awvwgk
  authored
  d900fc7
Commits on Oct 26, 2026
- Use the correct image cutoff for periodic CN derivatives (#404)
  Growl1234
  authored
  ff5a830
Commits on Oct 22, 2026
- CMake: Use DFTD4_INSTALL_FMODDIR (#405)
  Growl1234
  authored
  319bcca
Commits on Oct 13, 2026
- Fix `r2scan-cidh` parameters in TOML file (#406)
  marvinfriede
  authored
  00a263f
Commits on Sep 28, 2026
- Bump version to 4.3.0 (#401)
  awvwgk
  authored
  d5f8918
- Analytic second derivatives for ATM (#398)
  Growl1234
  authored
  00be0b7
Commits on Sep 27, 2026
- Bump mctc-lib to 0.6.1 (#400)
  marvinfriede
  authored
  c0aaced
Commits on Sep 5, 2026
- Bump JamesIves/github-pages-deploy-action from 4.8.0 to 4.9.0 (#397)
  dependabot[bot]
  authored
  82fbaf4
- Bump actions/download-artifact from 4 to 8 (#399)
  dependabot[bot]
  authored
  34bfb39
Commits on Aug 17, 2026
- Enable building Python API with CMake (#393)
  Growl1234
  authored
  419be1f
Commits on Aug 16, 2026
- Add external work partitioning for dispersion evaluation (#395)
  Growl1234
  authored
  30c5b81
Commits on Jul 29, 2026
- Add get_numerical_hessian_api into public API (#392)
  susilehtola
  authored
  f84dc40
- Document cutoffs for ASE calculator (#378)
  awvwgk
  authored
  8ceaea8
Commits on Jul 28, 2026
- Fix all linter issues (#389)
  awvwgk
  authored
  9952be7
Commits on Jul 27, 2026
- Bump actions/checkout from 4 to 7 (#390)
  dependabot[bot]
  authored
  0c9f9f2
- Bump actions/setup-python from 5 to 7 (#391)
  dependabot[bot]
  authored
  4a755e7
Commits on Jul 20, 2026
- Format Python API with ruff (#387)
  awvwgk
  authored
  f28a6e6
- Add fortitude linter (#385)
  awvwgk
  authored
  7e911ca
- Bump actions/setup-python from 6 to 7 (#386)
  dependabot[bot]
  authored
  f5a4c3c
Commits on Jul 6, 2026
- Turn off OMP for coverage (#384)
  marvinfriede
  authored
  4c67883
Commits on Jul 4, 2026
- Restrict coverage to core library (#383)
  marvinfriede
  authored
  c54d366
Commits on Jul 2, 2026
- Fix code scanning alerts (#382)
  marvinfriede
  authored
  f6e09df
Commits on Jul 1, 2026
- chore: fix typos (#375)
  e-kwsm
  authored
  dc6e586
- Fix MACOSX deployment target (#381)
  marvinfriede
  authored
  8c4a65f
- Bump actions/cache from 5 to 6 (#379)
  dependabot[bot]
  authored
  1c1cdce
- Bump codecov/codecov-action from 6 to 7 (#368)
  dependabot[bot]
  authored
  814e3cd
- Bump actions/checkout from 6 to 7 (#376)
  dependabot[bot]
  authored
  84f5349
Commits on Jun 18, 2026
- Fix readthedocs build (#374)
  awvwgk
  authored
  3f40e36
- fix: convert ASE unit constants to float to fix broken arithmetic (#373)
  Copilot
  authored
  b554ed3
Commits on Jun 15, 2026
- Update dependencies (#371)
  awvwgk
  authored
  0135d16
Commits on Jun 12, 2026
- Add CMake export for meson build (#369)
  awvwgk
  authored
  930539a
Commits on May 20, 2026
- Bump fortran-lang/setup-fpm from 9 to 10 (#365)
  dependabot[bot]
  authored
  84cebc0

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