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    6 repositories

    • dftbplus

      Public
      DFTB+ general package for performing fast atomistic simulations
      Fortran
      •
      Other
      •185•0•0•0•Updated Feb 20, 2026Feb 20, 2026

    • QFiND.jl

      Public
      Quantum Finite-temperature Noise Discretizer (Decomposer)
      Julia
      •
      MIT License
      •0•0•0•1•Updated Dec 19, 2025Dec 19, 2025

    • ash

      Public
      ASH is a Python-based computational chemistry and QM/MM environment, primarily for molecular calculations in the gas phase, explicit solution, crystal or prote…
      Python
      •
      GNU General Public License v2.0
      •24•0•0•0•Updated Dec 10, 2025Dec 10, 2025

    • ExpFit.jl

      Public
      Exponential Fitting Package
      Julia
      •
      MIT License
      •0•0•0•1•Updated Nov 24, 2025Nov 24, 2025

    • .github

      Public
      0•0•0•0•Updated Feb 12, 2025Feb 12, 2025

    • ttpy

      Public
      Python implementation of the TT-Toolbox
      Python
      •
      MIT License
      •73•0•0•0•Updated Jan 31, 2025Jan 31, 2025
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