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    • LAMMPS plugin for AiiDA
      Python
      MIT License
      152552Updated Dec 10, 2024Dec 10, 2024
    • AiiDA plugin for DFTK
      Python
      MIT License
      0380Updated Nov 25, 2024Nov 25, 2024
    • AiiDA plugin for the FLEXPART code (simulation of atmospheric transport processes)
      Python
      MIT License
      0321Updated Sep 27, 2024Sep 27, 2024
    • aiida-ase

      Public
      AiiDA plugin for ASE
      Python
      MIT License
      9500Updated Sep 5, 2024Sep 5, 2024
    • Plugin to combine Wannier90 interpolations with GW corrections computed by Yambo
      Python
      MIT License
      1030Updated Feb 19, 2024Feb 19, 2024
    • WIEN2k plug-in for AiiDA workflow management
      Python
      MIT License
      1300Updated Dec 22, 2023Dec 22, 2023
    • Docker stack for testing WIEN2k
      Dockerfile
      1001Updated Sep 19, 2023Sep 19, 2023
    • A plugin for AiiDA, to run the CRYSTAL17 code
      Python
      GNU Lesser General Public License v3.0
      4530Updated Sep 3, 2021Sep 3, 2021
    • .github

      Public
      Community health files: Contributing guidelines, Code of Conduct, ...
      MIT License
      0000Updated Sep 18, 2020Sep 18, 2020
    • AiiDA plugin for use with GULP
      Python
      GNU Lesser General Public License v3.0
      0000Updated Oct 30, 2019Oct 30, 2019
    • An aiida scheduler for the Imperial College London cx1 HPC
      Python
      MIT License
      2100Updated Jul 24, 2019Jul 24, 2019