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doped_QE
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doped is a Python software for the generation, pre-/post-processing and analysis of defect s.upercell calculations, implementing the defect simulation workflow in an efficient, reproducible, user-f…
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pymatgen-io-espresso
pymatgen-io-espresso PublicForked from Griffin-Group/pymatgen-io-espresso
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pymatgen-analysis-defects
pymatgen-analysis-defects PublicForked from materialsproject/pymatgen-analysis-defects
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