• Formula : SbS8Cl3
  • Space Group : P-1 (2)
    Centrosymmetric : True
    Dimensionality : 2D
  • Structure parameters
    a = 8.05
    b = 8.67
    c = 10.73
    α = 94.93
    β = 107.1
    γ = 111.57
  • Number of atoms per primitive cell = 24
    Total number of electrons per primitive cell = 148
  • Band gap = 2.714 eV
    Direct Gap = 2.763 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 35741

Band structure with spin-orbit coupling