materialsproject/pymatgen

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 Project.

1,776
PythonOther
materialsmaterials-informaticsmaterials-sciencepythonscience
Stars

1,776

Updated

Nov 26, 2025

Stars Over Time

Top Contributors

Related Repositories

Track developers from materialsproject/pymatgen

Join 1,000+ companies finding quality developer leads