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  1. transport-coefficients-MSD transport-coefficients-MSD Public

    Code to compute Onsager transport coefficients from molecular dynamics simulations using mean-square displacements.

    Jupyter Notebook 24 5

  2. transport-coefficients transport-coefficients Public

    Example code to compute Onsager transport coefficients from molecular dynamics simulations.

    Jupyter Notebook 5

  3. pymatgen pymatgen Public

    Forked from materialsproject/pymatgen

    Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It i…

    Python

  4. handbook handbook Public

    Forked from perssongroup/handbook

    Persson Group Handbook

    JavaScript

  5. kdfong.github.io kdfong.github.io Public

    Forked from academicpages/academicpages.github.io

    Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes

    JavaScript

  6. mdgo mdgo Public

    Forked from HouGroup/mdgo

    A codebase for classical molecular dynamics (MD) simulation setup and results analysis.

    Python

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