mlips

There are 3 repositories under mlips topic.

  • autoatml/autoplex

    Code for automated fitting of machine learned interatomic potentials.

    Language:Python121411418

  • basf/mlipx

    Machine-Learned Interatomic Potential eXploration (mlipx) is designed at BASF for evaluating machine-learned interatomic potentials (MLIPs). It offers a growing set of evaluation methods alongside powerful visualization and comparison tools.

    Language:Python924147

  • RastislavTuranyi/ml_phonon_scripts

    Collection of scripts for running phonon calculations using machine-learned interatomic potentials

    Language:Jupyter Notebook1100