• Formula : AlBi2Se2BrCl4
  • Space Group : P-1 (2)
    Centrosymmetric : True
    Dimensionality : 2D
  • Structure parameters
    a = 6.8705
    b = 8.2425
    c = 11.48
    α = 69.096
    β = 73.458
    γ = 72.469
  • Number of atoms per primitive cell = 20
    Total number of electrons per primitive cell = 160
  • Band gap = 0.5475 eV
    Direct Gap = 1.018 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 251017

Band structure with spin-orbit coupling