• Formula : SbPbClO2
  • Space Group : Cmcm (63)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 5.603
    b = 12.245
    c = 5.448
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 10
    Total number of electrons per primitive cell = 76
  • Band gap = 0.0 eV
    Direct Gap = 1.773 eV
    Metallicity = 1.000
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Riesame della struttura cristallina della nadorite: PbSbO2Cl Locality: Djebel Nador, Algeria,
    Periodico di Mineralogia 42, 335 (1973)

Band structure with spin-orbit coupling