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@thunder-dft FIREBALL2020 DFT Development Group

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    7 repositories

    • thunder-fireball

      Public
      This is the package that will run fireball.x which does energy and force calculations with molecular dynamics implementations.
      Jupyter Notebook
      •
      GNU General Public License v3.0
      •2•1•1•0•Updated Apr 1, 2026Apr 1, 2026

    • thunder-master

      Public
      This is the master directory containing all the modules for the FIREBALL codes. All the codes utilize the same modules to maintain input and output consistency …
      Fortran
      •
      GNU General Public License v3.0
      •7•2•0•0•Updated Feb 3, 2026Feb 3, 2026

    • thunder-ase

      Public
      The interface of ASE for FIREBALL.
      fireballase
      fireballase
      Python
      •2•4•1•0•Updated May 22, 2025May 22, 2025

    • thunder-lightning-grid

      Public
      This is the package that will run the lightning.x code which does energy only calculations using the density on the grid approach.
      Fortran
      •
      GNU General Public License v3.0
      •1•0•0•0•Updated Nov 29, 2023Nov 29, 2023

    • thunder-lightning

      Public
      This is the package that will run the lightning.x code which does energy only calculations.
      Jupyter Notebook
      •
      GNU General Public License v3.0
      •2•0•0•0•Updated Nov 29, 2023Nov 29, 2023

    • thunder-doc

      Public
      Documentation of thunder-dft
      TeX
      •0•0•0•0•Updated Nov 27, 2023Nov 27, 2023

    • thunder-dft.github.io

      Public
      These are documentation files on how to build the FIREBALL codes.
      HTML
      •1•0•0•0•Updated Jun 13, 2023Jun 13, 2023
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