• Formula : ZnCdPt2
  • Space Group : P4/mmm (123)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 2.9
    b = 2.9
    c = 7.24
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 4
    Total number of electrons per primitive cell = 44
  • Band gap = 0.0 eV
    Direct Gap = 0.013 eV
    Metallicity = 0.693
    Topological Z2 indices ν = (1;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Ueber einige Strukturen im System Pt-Zn-Cd.,
    Journal of the Less-Common Metals 20, 266 (1970)

Band structure with spin-orbit coupling