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materialsvirtuallab / matgl

Graph deep learning library for materials
BSD 3-Clause "New" or "Revised" License
233 stars 57 forks source link

Bump pymatgen from 2023.10.4 to 2023.10.11 #183

Closed dependabot[bot] closed 9 months ago

dependabot[bot] commented 9 months ago

Bumps pymatgen from 2023.10.4 to 2023.10.11.

Release notes

Sourced from pymatgen's releases.

v2023.10.11

🐛 Bug Fixes

🛠 Enhancements

📖 Documentation

🧹 House-Keeping

🧪 Tests

💥 Breaking Changes

🏷️ Type Hints

Full Changelog: https://github.com/materialsproject/pymatgen/compare/v2023.10.4...v2023.10.11

Changelog

Sourced from pymatgen's changelog.

v2023.10.11

🐛 Bug Fixes

🛠 Enhancements

📖 Documentation

🧹 House-Keeping

🧪 Tests

💥 Breaking Changes

🏷️ Type Hints

Full Changelog: https://github.com/materialsproject/pymatgen/compare/v2023.10.4...v2023.10.11

Commits
  • 15dc77d v2023.10.11
  • 6e7e8f0 Fix OBAlign(includeH=False, symmetry=False) can't take keywords (#3403)
  • b9a4ef4 Revert Self usage (#3401)
  • 38db1dd MatPESStaticSet.yaml set LMAXMIX: 6 (#3400)
  • 92d00cd add TODO comment re overwriting blocks with equal headers in CifFile.from_str()
  • 63d7605 Add mode: Literal["w", "a", "wt", "at"] = "w" keyword to `CifWriter.write_f...
  • c818aa7 mirror atomate2 fix and improve test_kspacing edge case coverage (#3396)
  • 30d11bb clean up verbose use of plotly.graph_objects API
  • c7e0355 Further updating POTCAR validation / identification (#3392)
  • 14a6c56 Fix ruff N806 (#3394)
  • Additional commits viewable in compare view


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codecov[bot] commented 9 months ago

Codecov Report

All modified lines are covered by tests :white_check_mark:

Comparison is base (ebabecd) 98.00% compared to head (55b959b) 98.00%.

Additional details and impacted files ```diff @@ Coverage Diff @@ ## main #183 +/- ## ======================================= Coverage 98.00% 98.00% ======================================= Files 28 28 Lines 1901 1901 ======================================= Hits 1863 1863 Misses 38 38 ```

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