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  • mace_fork Public

    Forked from ACEsuit/mace

    MACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.

    Python Other Updated Oct 9, 2024
  • atomate2 is a library of computational materials science workflows

    Python Other Updated Nov 23, 2023
  • LobsterPy Public

    Forked from JaGeo/LobsterPy

    Package to perform automatic bonding analysis with the program Lobster in the field of computational materials science and quantum chemistry

    Python BSD 3-Clause "New" or "Revised" License Updated Oct 16, 2023
  • Config files for my GitHub profile.

    Updated Sep 21, 2023