• Formula : SbN9
  • Space Group : R-3 (148)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 7.6998
    b = 7.6998
    c = 7.6998
    α = 55.787
    β = 55.787
    γ = 55.787
  • Number of atoms per primitive cell = 20
    Total number of electrons per primitive cell = 100
  • Band gap = 2.7027 eV
    Direct Gap = 2.734 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 413359

Band structure with spin-orbit coupling