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  1. materialyzeai/matcalc materialyzeai/matcalc Public

    A python library for calculating materials properties from the PES

    Python 125 31

  2. materialyzeai/matgl materialyzeai/matgl Public

    Graph deep learning library for materials

    Python 477 103

  3. materialyzeai/matpes materialyzeai/matpes Public

    A foundational potential energy dataset for materials

    Jupyter Notebook 46 4