• Formula : V2CdO4
  • Space Group : Fd-3m (227)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 8.695
    b = 8.695
    c = 8.695
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 14
    Total number of electrons per primitive cell = 124
  • Band gap = 0.0 eV
    Direct Gap = 0.009 eV
    Metallicity = 0.528
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Zur kristallchemie der vanadin(III)-spinelle,
    Zeitschrift fur Anorganische und Allgemeine Chemie 369, 306 (1969)

Band structure with spin-orbit coupling