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  1. MTD-group/Fermi-Surface MTD-group/Fermi-Surface Public

    VASP subtool to draw Fermi-Surface; creates input file for Xcrysden

    Python 37 17

  2. VASP-Structural_Descriptors VASP-Structural_Descriptors Public

    Pymatgen-based script to collect structural descriptors from many atomic structures.

    Python 10 5

  3. VASP-DOS_extractor VASP-DOS_extractor Public

    Pymatgen-based python script to extract density of states (DOS) and projected DOS from vasprun.xml file

    Python 8 10

  4. Cathalide Cathalide Public

    Manipulate cations (especially organic molecules) in hybrid halide perovskites

    Jupyter Notebook 2 1