• Formula : Ba2Cd3Bi4
  • Space Group : Cmce (64)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 7.001
    b = 17.33
    c = 9.224
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 18
    Total number of electrons per primitive cell = 232
  • Band gap = 0.0 eV
    Direct Gap = 0.023 eV
    Metallicity = 0.679
    Topological Z2 indices ν = (1;110)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 416445

Band structure with spin-orbit coupling