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  1. ascii-phonons ascii-phonons Public

    Blender extensions for illustrations of phonons

    Python 60 22

  2. mctools mctools Public

    Quick tools for materials chemistry

    Python 15 6

  3. abins-mode-intensities abins-mode-intensities Public

    A snakemake workflow to produce mode-resolved INS intensities in incoherent approximation

    Python

  4. abins-qpt-convergence abins-qpt-convergence Public

    A snakemake workflow to check q-point sampling convergence of AbINS spectra

    Python

  5. dotfiles dotfiles Public

    My dotfiles, version N+1

    Shell

  6. molden-to-abins molden-to-abins Public

    File converter from Molden to Abins-JSON

    Python