github materialsproject/pymatgen v2019.7.2

latest releases: v2024.9.17.1, v2024.9.17, v2024.9.10...
5 years ago
  • Improvements to grain boundary transformations and Rester (@Tinaatucsd)
  • Improvements to AdsorbateSiteFinder (@oxana-a)
  • Improvements to Waveder support (@JRSuckert)
  • Improvements to run type detection (@darnoceloc)
  • Add XAS data to Rester (@yimingchen95)
  • Fix to ATAT input/output (@dongsenfo)
  • Initial support for Prismatic input (@mkhorton)

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