• Formula : SbO2
  • Space Group : C2/c (15)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 12.061
    b = 4.836
    c = 5.383
    α = 90.0
    β = 104.6
    γ = 90.0
  • Number of atoms per primitive cell = 12
    Total number of electrons per primitive cell = 68
  • Band gap = 0.0 eV
    Direct Gap = 2.618 eV
    Metallicity = 1.000
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Clinocervantite, B-Sb2O4, the natural monoclinic polymorph of cervantite from the Cetine mine, Siena, Italy Note: z-coordinate to O2 altered by communications with R Basso, April, 2003 Locality: Cetine mine, Siena, Italy,
    European Journal of Mineralogy 11, 95 (1999)

Band structure with spin-orbit coupling