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pymatgen
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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…
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matgenb
matgenb PublicForked from materialsvirtuallab/matgenb
Jupyter notebooks demonstrating the utilization of open-source codes for the study of materials science.
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mdanalysis
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kokkos_perf_testing
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kokkos
kokkos PublicForked from kokkos/kokkos
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