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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 13 5

  3. Cathalide Cathalide Public

    Manipulate cations (especially organic molecules) in hybrid halide perovskites

    Jupyter Notebook 2 1

  4. Defect_calc_tool Defect_calc_tool Public

    Python script to conveniently perform the defect calculations

    Python 2