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SMTG-Bham
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doped
doped is a Python software for the generation, pre-/post-processing and analysis of defect supercell calculations, implementing the defect simulation workflow in an efficient, reproducible, user-friendly yet powerful and fully-customisable manner.
https://doped.readthedocs.io
MIT License
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#53
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kavanase
closed
6 months ago
kavanase
commented
6 months ago
All tests passing, merging
All tests passing, merging