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@MaterSim

Materials Simulation Group

Materials Simulation Group at UNCC (Qiang Zhu)

Popular repositoriesLoading

  1. PyXtalPyXtalPublic

    A code to generate atomic structure with symmetry

    Python 349 78

  2. ComputationalPhysics300ComputationalPhysics300Public

    computational physics class taught at UNLV (Phys300)

    Jupyter Notebook 128 123

  3. PyXtal_FFPyXtal_FFPublic

    Machine Learning Interatomic Potential Predictions

    Python 94 24

  4. vasprunvasprunPublic

    quick analysis of vasp calculation

    Python 38 15

  5. CMSCMSPublic

    Some ongoing projects in Zhu's group

    HTML 28 8

  6. LEGO-xtalLEGO-xtalPublic

    LEGO-Cryst: Local Environment Geometry-Oriented Crystal Generator

    Python 8 3

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