• Formula : MgPd
  • Space Group : Pm-3m (221)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 3.12
    b = 3.12
    c = 3.12
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 2
    Total number of electrons per primitive cell = 28
  • Band gap = 0.0 eV
    Direct Gap = 0.044 eV
    Metallicity = 0.512
    Topological Z2 indices ν = (1;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Ternaere Kohlenstofflegierungen von Palladium und Platin mit Mg, Al, Zn, Ga, Ge, Cd, In, Sn, Hg, Tl und Pb,
    Zeitschrift fuer Metallkunde 52, 391 (1961)

Band structure with spin-orbit coupling