Pymatgen

Latest version: v2024.5.1

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2020.3.2

Not secure
* New MonteCarloRattleTransformation and phonopy integration (utf)
* New structure connectivity features in Chemenv analysis (davidwaroquiers)
* Bug fixes (CifLord, chc273, JaGeo, dskoda, rkingsbury,
jmmshn, espottesmith, gVallverdu, yimingchen95, fraricci)

2020.1.28

Not secure
* Plugin architecture for pymatgen.
* Improvements to pymatgen.analysis.xas.spectrum.XAS class. (yiming)
* Fixes for ISYM uniform bug and auto-NEDSO (fraricci)
* Improvements to ReactionDiagram.
* Chemenv improvements (davidwaroquiers)
* Misc bug fixes.

2020.1.10

Not secure
* New connectivity analysis in Chemenv (davidwaroquiers)
* Improvements to DOSPlotter (uthpalah)
* Improvements to writing VASP input sets (rkingsbury)
* Bug fix for PhaseDiagram (montoyjh)

2019.12.22

Not secure
* Improvements to reaction calculator (mattmcdermott)
* VASP input set for SCAN from Materials Project, MPScanSet (rkingsbury)
* Bug fixes and documentation improvements (LindaHung-TRI, rkingsbury, kwaters4, rwoodsrobinson, JaGeo, nishiyamat, smheidrich)

2019.12.3

Not secure
* Respect KSPACING in INCAR.
* Bug fixes.

2019.11.11

Not secure
* Extend grosspop class (Jageo)
* Add option to VaspInputSet to write output with POTCAR.spec
* Add sort_structure option to Poscar.
* Added ability to make gaussian input file without a geometry (WardLT)
* Misc big fixes.

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