/atomate2-lammps

An add-on package for atomate2 that implements workflows for the LAMMPS molecular dynamics code.

Primary LanguagePythonOtherNOASSERTION

atomate2-lammps

This is an add-on package for atomate2 that includes core workflows for the LAMMPS molecular dynamics simulator.

License

This add-on is released under the same license as atomate2, modified BSD, the full text of which can be found in this repository.

Status

This package is still under development and the API may change at any time.