• Formula : Mg3Pt
  • Space Group : P6_3/mmc (194)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.577
    b = 4.577
    c = 8.322
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 8
    Total number of electrons per primitive cell = 80
  • Band gap = 0.0 eV
    Direct Gap = 0.009 eV
    Metallicity = 0.729
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Research on the alloys of noble metals with the more electro- positive elements. III. Micrographic and X-ray examination of Mg-Pt alloys,
    Journal of the Less-Common Metals 2, 383 (1960)

Band structure with spin-orbit coupling