• Formula : Zn7Sb8Ru9
  • Space Group : Fm-3m (225)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 11.9062
    b = 11.9062
    c = 11.9062
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 24
    Total number of electrons per primitive cell = 268
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.697
    Topological Z2 indices ν = (1;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Ru9Zn7Sb8: A Structure with a 2 x 2 x 2 Supercell of the Half-Heusler Phase,
    Inorganic Chemistry 49, 10536 (2010)

Band structure with spin-orbit coupling