PhD student studying computational materials science
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University of California, Berkeley
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08:10
(UTC -07:00) - in/matthew-kuner
- https://scholar.google.com/citations?user=Mff-qs4AAAAJ&hl=en
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materialsproject/pymatgen-io-validation
materialsproject/pymatgen-io-validation PublicComprehensive input/output validator. Made with the purpose of ensuring VASP calculations are compatible with Materials Project data, with possible future expansion to cover other DFT codes.
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materialsproject/pymatgen
materialsproject/pymatgen PublicPython Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials …
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materialsproject/atomate2
materialsproject/atomate2 Publicatomate2 is a library of computational materials science workflows
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