Pinned Loading

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 1.9k 966

2. pycalphad/pycalphad pycalphad/pycalphad Public

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

   Python 402 137