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  • dynamical-fitting Public

    Python 7 GNU General Public License v3.0 Updated Jan 7, 2025

  • IR-opt Public

    Python Updated Jun 25, 2024

  • DMFF Public

    Forked from deepmodeling/DMFF

    DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable implementation of molecular force field models.

    Python GNU Lesser General Public License v3.0 Updated Apr 7, 2024

  • ice-hanbin.github.io Public

    Forked from academicpages/academicpages.github.io

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

    JavaScript MIT License Updated Sep 3, 2023

  • demo-repo Public

    HTML Updated Sep 29, 2022

  • pyscf Public

    Forked from fishjojo/pyscf

    Python module for quantum chemistry

    Python Apache License 2.0 Updated Sep 7, 2022

  • properties Public

    Forked from fishjojo/properties

    Molecular and crystal electromagnetic properties

    Python Apache License 2.0 Updated Jun 6, 2022