Releases: JaGeo/LobsterPy
Releases · JaGeo/LobsterPy
v0.5.0
What's Changed
- Update CHANGELOG.md by @JaGeo in #334
- Ci updates by @naik-aakash in #341
- Update get struct path by @naik-aakash in #340
- Bump mendeleev from 0.17.0 to 0.18.1 by @dependabot in #338
- Bump sphinx-toolbox from 3.8.0 to 3.8.1 by @dependabot in #339
- Bump myst-nb from 1.1.1 to 1.1.2 by @dependabot in #335
- pin min pymatgen version > lobster 5.0/5.1 support by @naik-aakash in #342
Full Changelog: v0.4.9...v0.5.0
v0.4.9
Same as.v0.4.8
Full Changelog: v0.4.8...v0.4.9
v0.4.8
What's Changed
- change python version from 3.9 to 3.10 in docs generation by @naik-aakash in #322
- Bump sphinx-design from 0.6.0 to 0.6.1 by @dependabot in #324
- Bump sphinx-toolbox from 3.7.0 to 3.8.0 by @dependabot in #326
- Update sphinx requirement from <8,>=5 to >=5,<9 by @dependabot in #323
- Update calc quality and fingerprints usage by @naik-aakash in #331
- Remove redundant coverage uploads and fix coverage reports by @naik-aakash in #332
- Fix the path of lobsterenv.py. by @hongyi-zhao in #333
New Contributors
- @hongyi-zhao made their first contribution in #333
Full Changelog: v0.4.7...v0.4.8
v0.4.7
What's Changed
- fix outdated cli tutorial code snippets by @naik-aakash in #320
- Fix unexpected "DOSCAR.LSO.lobster" exception in cli by @naik-aakash in #321
Full Changelog: v0.4.6...v0.4.7
v0.4.6
What's Changed
- CI Updates by @naik-aakash in #314
- Move to src layout by @naik-aakash in #315
- Bump sphinx-toolbox from 3.6.0 to 3.7.0 by @dependabot in #313
Full Changelog: v0.4.5...v0.4.6
v0.4.5
What's Changed
- Bump mendeleev from 0.15.0 to 0.16.0 by @dependabot in #288
- pre-commit autoupdate by @pre-commit-ci in #289
- Bump mendeleev from 0.16.0 to 0.16.1 by @dependabot in #290
- Bump mendeleev from 0.16.1 to 0.16.2 by @dependabot in #291
- Bump sphinx-design from 0.5.0 to 0.6.0 by @dependabot in #292
- Bump mendeleev from 0.16.2 to 0.17.0 by @dependabot in #296
- pre-commit autoupdate by @pre-commit-ci in #294
- Bump sphinx-book-theme from 1.1.2 to 1.1.3 by @dependabot in #298
- Fix warnings by @naik-aakash in #299
- Update readme by @naik-aakash in #302
- Explicitly use
agg
backend to avoid OS inconsistency by @DanielYang59 in #305 - Update orbitalwise analysis by @naik-aakash in #300
- Update numpy requirement from <2.0.0 to <3.0.0 by @dependabot in #309
- Bump sphinx-toolbox from 3.5.0 to 3.6.0 by @dependabot in #310
- Bump myst-nb from 1.1.0 to 1.1.1 by @dependabot in #311
- clarify kpoints requirements and limitations with input sets by @naik-aakash in #307
New Contributors
- @DanielYang59 made their first contribution in #305
Full Changelog: v0.4.4...v0.4.5
v0.4.4
v0.4.3
v0.4.2
v0.4.1
What's Changed
- clean up DOSCAR.LSO.lobster handling and add cli test for POSCAR.lobster by @naik-aakash in #257
- Fix saving of plots by @JaGeo in #262
- fix linting by @JaGeo in #263
- fix automatic plotting for large structures by @JaGeo in #265
- Update README.md by @JaGeo in #266
- Update README.md by @JaGeo in #267
- add code of conduct by @naik-aakash in #268
- pre-commit autoupdate by @pre-commit-ci in #270
- indicate python versions correctly. by @JaGeo in #271
- Update pymatgen version by @JaGeo in #273
- Bump myst-nb from 1.0.0 to 1.1.0 by @dependabot in #274
- Update pyproject.toml by @JaGeo in #275
- Update CHANGELOG.md by @JaGeo in #276
New Contributors
- @pre-commit-ci made their first contribution in #270
Full Changelog: v0.4.0...v0.4.1