• Formula : Rb(SbSe2)2
  • Space Group : P-1 (2)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 6.443
    b = 7.075
    c = 9.677
    α = 81.02
    β = 85.73
    γ = 74.47
  • Number of atoms per primitive cell = 14
    Total number of electrons per primitive cell = 86
  • Band gap = 1.0963 eV
    Direct Gap = 1.399 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 402887

Band structure with spin-orbit coupling