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    4 repositories

    • NEAR

      Public
      Python
      •
      BSD 3-Clause "New" or "Revised" License
      •0•1•0•0•Updated Sep 5, 2024Sep 5, 2024

    • CoRe_optimizer

      Public
      Continual Resilient (CoRe) Optimizer for PyTorch
      Python
      •
      BSD 3-Clause "New" or "Revised" License
      •0•9•0•0•Updated Jun 10, 2024Jun 10, 2024

    • reBoot

      Public
      Statistical calibration of property models
      MATLAB
      •
      GNU General Public License v3.0
      •0•1•0•0•Updated Jun 24, 2017Jun 24, 2017

    • OrbitalPerturbation

      Public
      Utility for the perturbation of molecular orbitals delivered by standard quantum chemical packages
      dftquantum-chemistryhartree-fock
      C++
      •
      GNU Lesser General Public License v3.0
      •1•7•0•0•Updated Feb 27, 2017Feb 27, 2017