kumagai-group/pydefect kumagai-group/pydefect

  • Stars
    star
    45
  • Rank 624,037 (Top 13 %)
  • Language
    Python
  • License
    MIT License
  • Created over 4 years ago
  • Updated 7 months ago
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kumagai-group/pydefect
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Repository Details

Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.

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