• Formula : SrMg
  • Space Group : Pm-3m (221)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 3.908
    b = 3.908
    c = 3.908
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 2
    Total number of electrons per primitive cell = 20
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.620
    Topological Z2 indices ν = (0;111)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Die Kristallstrukturen von Ni5 Ce, Ni5 Ca, Cu5 La, Cu5 Ca, Zn5 La, Zn5 Ca, Ni2 Ce, Mg Ce, Mg La und Mg Sr,
    Zeitschrift fuer Metallkunde 34, 247 (1942)

Band structure with spin-orbit coupling