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2.4.4

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@github-actions github-actions released this 05 Jun 19:32
  • Make oxidation state guessing more efficient, semi-significant speed up in generation/parsing for tough cases.
  • Add bulk_site_concentration property to DefectEntry, giving the concentration of the corresponding lattice site of that defect in the pristine bulk.
  • Minor updates to ensure compatibility with recent pymatgen and ASE releases.