8000 ricardonpa (Ricardo Amaral) · GitHub
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Achievement: QuickdrawAchievement: Pull Shark

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  1. materialsproject/pymatgen materialsproject/pymatgen Public

    Python 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 …

    Python 1.7k 904

  2. pycalphad/pycalphad pycalphad/pycalphad Public

    CALPHAD tools for designing thermodynamic models, calculating phase diagrams and investigating phase equilibria.

    Python 330 114

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