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pymatgen
pymatgen PublicForked from materialsproject/pymatgen
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It i…
Python 1
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matminer
matminer PublicForked from hackingmaterials/matminer
Data mining for materials science
HTML
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atomate2
atomate2 PublicForked from materialsproject/atomate2
atomate2 is a library of computational materials science workflows
Python
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emmet
emmet PublicForked from materialsproject/emmet
Be a master builder of databases of material properties. Avoid the Kragle.
Python
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pymatgen-analysis-diffusion
pymatgen-analysis-diffusion PublicForked from materialsvirtuallab/pymatgen-analysis-diffusion
This add-on to pymatgen provides tools for analyzing diffusion in materials.
Python
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atomate
atomate PublicForked from jsyony37/atomate
atomate is a powerful software for computational materials science and contains pre-built workflows.
Python
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