• Formula : KSbO3
  • Space Group : R-3 (148)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 6.814
    b = 6.814
    c = 6.814
    α = 46.33
    β = 46.33
    γ = 46.33
  • Number of atoms per primitive cell = 10
    Total number of electrons per primitive cell = 64
  • Band gap = 2.1217 eV
    Direct Gap = 2.300 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    X-Ray Studies on Potassium Antimonates,
    Arkiv foer Kemi, Mineralogi och Geologi, A 14, 1 (1940)

Band structure with spin-orbit coupling