Popular repositories Loading

1. nequip nequip Public

   NequIP is a code for building E(3)-equivariant interatomic potentials

   Python 727 157

2. allegro allegro Public

   Allegro is an open-source code for building highly scalable and accurate equivariant deep learning interatomic potentials

   Python 394 55

3. flare flare Public

   An open-source Python package for creating fast and accurate interatomic potentials.

   Python 322 70

4. pair_nequip pair_nequip Public

   Deprecated - see `pair_nequip_allegro`

   C++ 43 13

5. pair_nequip_allegro pair_nequip_allegro Public

   LAMMPS pair styles for NequIP and Allegro deep learning interatomic potentials

   C++ 41 8

6. flare_pp flare_pp Public

   A many-body extension of the FLARE code.

   C++ 37 7