• Formula : SbO3
  • Space Group : P2_1/c (14)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 5.2526
    b = 4.7331
    c = 8.6322
    α = 90.0
    β = 90.8
    γ = 90.0
  • Number of atoms per primitive cell = 16
    Total number of electrons per primitive cell = 92
  • Band gap = 0.0 eV
    Direct Gap = 0.015 eV
    Metallicity = 0.301
    Topological Z2 indices ν = (1;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Li/H topotactic exchange on LiSbO3: The series Li(1-x)HxSbO3 (0<=x<=1). _cod_database_code 1000143,
    Materials Research Bulletin 24, 1207 (1989)

Band structure with spin-orbit coupling