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  1. PDOS PDOS Public

    To plot the projected density of state

    Python 1

  2. Madelung-potential Madelung-potential Public

    The determination of Madelung potential for Finite Size Effect

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  3. Defect-determination Defect-determination Public

    Count the Defect Number in Displacement Cascades

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    Lattice Parameter determine

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  5. Defect-formation-energy Defect-formation-energy Public

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  6. Defect-concentration Defect-concentration Public

    To determine the defect concentration

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