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  1. mir-group/flare mir-group/flare Public

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

    Python 278 64

  2. mir-group/nequip mir-group/nequip Public

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

    Python 566 127

  3. mir-group/pytorch_runstats mir-group/pytorch_runstats Public

    Running/online statistics for PyTorch

    Python 2 1

  4. aiida-cusp aiida-cusp Public

    Forked from aiida-cusp/aiida-cusp

    Custodian based VASP Plugin for AiiDA

    Python

  5. mir-group/NDSimulator mir-group/NDSimulator Public

    An open-source python code for simple N-dimensional molecular dynamics and enhanced samplings

    Python 1

  6. mir-group/MLmtCV mir-group/MLmtCV Public

    Python