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Coudert lab

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  1. elate elate Public

    ELATE: Elastic tensor analysis

    Jupyter Notebook 78 37

  2. CrystalNets.jl CrystalNets.jl Public

    A julia package for the manipulation of crystal net representations and topology

    Julia 43 3

  3. CoRE-MOF CoRE-MOF Public

    CoRE-MOF as a Python package

    Python 15

  4. amof amof Public

    A python package to analyze Molecular Dynamics (MD) trajectories of amorphous Metal-Organic Frameworks (MOFs).

    Python 11 1

  5. RAESS RAESS Public

    Rapid Adsorption Enthalpy Surface Sampling

    C++ 3

  6. GrAED GrAED Public

    Grid Adsorption Energy Descriptors

    C++ 1

Repositories

Showing 8 of 8 repositories
  • CrystalNets.jl Public

    A julia package for the manipulation of crystal net representations and topology

    Julia 43 MIT 3 1 0 Updated Mar 12, 2025
  • simple-adsorption-workflow Public
    Jupyter Notebook 1 0 0 0 Updated Feb 27, 2025
  • CoRE-MOF Public

    CoRE-MOF as a Python package

    Python 15 MIT 0 0 0 Updated Nov 21, 2024
  • elate Public

    ELATE: Elastic tensor analysis

    Jupyter Notebook 78 MIT 37 2 0 Updated Apr 12, 2024
  • FaEB Public Forked from eren125/FaEB

    Fast Energy Barrier (FaEB) evaluation tool to assess diffusion in nanoporous materials

    C++ 1 MIT 1 0 0 Updated Oct 11, 2023
  • RAESS Public

    Rapid Adsorption Enthalpy Surface Sampling

    C++ 3 MIT 0 0 0 Updated Oct 11, 2023
  • GrAED Public

    Grid Adsorption Energy Descriptors

    C++ 1 MIT 0 0 0 Updated Aug 30, 2023
  • amof Public

    A python package to analyze Molecular Dynamics (MD) trajectories of amorphous Metal-Organic Frameworks (MOFs).

    Python 11 MIT 1 1 0 Updated Aug 29, 2023