pymatgen 2024.2.8

v2024.2.8

on Python PyPI

What's Changed

🐛 Bug Fixes

• Fix Vasprun.get_potcars search method; tweak fake POTCARs by @esoteric-ephemera in #3587

🛠 Enhancements

• Aims input sets by @tpurcell90 in #3482
• Add SiteCollection.reduced_formula property by @janosh in #3610
• Add Entry.(formula|reduced_formula) by @janosh in #3611
• VASP IO copy() methods by @janosh in #3602

📖 Documentation

• Adding FHI-aims inputs developers by @tpurcell90 in #3592

🧹 House-Keeping

• chore: fix a typo by @VsevolodX in #3609

🧪 Tests

• Add tests for the New Vasp input sets by @Zhuoying in #3576

🏥 Package Health

• Switch macOS wheel building to new M1 runners by @janosh in #3596

🤷‍♂️ Other Changes

• Fix text formatting in bug_report.yaml by @Andrew-S-Rosen in #3589
• Minor update to avoid deprecation warning by @kavanase in #3601

New Contributors

• @VsevolodX made their first contribution in #3609

Full Changelog: v2024.1.27...v2024.2.8