• Formula : CrBiO3
  • Space Group : C2/c (15)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 9.468
    b = 5.4822
    c = 9.5865
    α = 90.0
    β = 108.574
    γ = 90.0
  • Number of atoms per primitive cell = 20
    Total number of electrons per primitive cell = 188
  • Band gap = 0.0 eV
    Direct Gap = 0.003 eV
    Metallicity = 0.244
    Topological Z2 indices ν = (1;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 174404

Band structure with spin-orbit coupling