• Formula : SnI2
  • Space Group : C2/m (12)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 14.17
    b = 4.535
    c = 10.87
    α = 90.0
    β = 92.0
    γ = 90.0
  • Number of atoms per primitive cell = 9
    Total number of electrons per primitive cell = 84
  • Band gap = 1.373 eV
    Direct Gap = 1.650 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 2831

Band structure with spin-orbit coupling