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@CompPhysVienna

CompPhysVienna

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  1. n2p2 n2p2 Public

    n2p2 - A Neural Network Potential Package

    C++ 245 95

  2. MLSummerSchoolVienna2022 MLSummerSchoolVienna2022 Public

    ESI-DCAFM-TACO-VDSP Summer School on "Machine Learning for Materials Hard and Soft"

    Jupyter Notebook 40 26

  3. Boltzmannator Boltzmannator Public

    Python 11

  4. paper_NF_for_rare_events paper_NF_for_rare_events Public

    Python 3

  5. paper_boltzmann2boltzmann paper_boltzmann2boltzmann Public

    Companion repository for the paper "Learning mappings between equilibrium states of liquid systems using Normalizing Flows" aka "Boltzmann 2 Boltzmann"

    Jupyter Notebook

  6. paper_ShootingPoint_MCMC paper_ShootingPoint_MCMC Public

    Jupyter Notebook

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