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  1. dpdata dpdata Public

    Forked from chouyoudou/dpdata

    Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc.

    Python

  2. Demo Demo Public

    How to build NN potential from OpenMX calculation result using DeePMD-kit

    Jupyter Notebook

  3. OMX2QE OMX2QE Public

    Converter from OpenMX to Quantum-Espresso like format

    Python

  4. nnp-jisso nnp-jisso Public

    Jupyter Notebook