• Formula : VGaCo2
  • Space Group : Fm-3m (225)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 5.782
    b = 5.782
    c = 5.782
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 4
    Total number of electrons per primitive cell = 60
  • Band gap = 0.0 eV
    Direct Gap = 0.011 eV
    Metallicity = 0.486
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    New ternary compounds with a structure of the Mn Cu2 Al type,
    Dopovidi Akademii Nauk Ukrains'koi RSR 1962, 1329 (1962)

Band structure with spin-orbit coupling