Popular repositories Loading

1. gnn_eads gnn_eads Public

   Python 1

2. quacc quacc Public

   Forked from Quantum-Accelerators/quacc

   quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.

   Python 1

3. ase ase Public

   Forked from yfyh2013/ase

   Atomic Simulation Environment - mirror of https://gitlab.com/ase/ase

   Python

4. pymatgen pymatgen Public

   Forked from 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 …

   Python