• Formula : MgCd
  • Space Group : Pmma (51)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 5.0051
    b = 3.2271
    c = 5.277
    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 = 0.023 eV
    Metallicity = 0.371
    Topological Z2 indices ν = (0;100)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The crystal structure of the cadmium-magnesium alloy, Cd Mg,
    Acta Crystallographica (1,1948-23,1967) 5, 247 (1952)

Band structure with spin-orbit coupling