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  1. matbench-discovery matbench-discovery Public

    Forked from janosh/matbench-discovery

    An evaluation framework for machine learning models simulating high-throughput materials discovery.

    Python 1

  2. tpot tpot Public

    Forked from comet-group/tpot

    Fortran

  3. surface-sampling surface-sampling Public

    Forked from learningmatter-mit/surface-sampling

    MCMC-based algorithm for sampling surface reconstructions

    Jupyter Notebook