• Formula : Cr5Se8
  • Space Group : C2/m (12)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 12.353
    b = 7.148
    c = 11.462
    α = 90.0
    β = 91.06
    γ = 90.0
  • Number of atoms per primitive cell = 13
    Total number of electrons per primitive cell = 118
  • Band gap = 0.0 eV
    Direct Gap = 0.006 eV
    Metallicity = 0.514
    Topological Z2 indices ν = (0;110)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 626705

Band structure with spin-orbit coupling