• Formula : W3O8
  • Space Group : C222 (21)
    Centrosymmetric : False
    Dimensionality : 3D
  • Structure parameters
    a = 6.386
    b = 10.43
    c = 3.798
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 11
    Total number of electrons per primitive cell = 132
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.791
    Topological Z2 indices ν = ?
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Two high-pressure tungsten oxide structures of W~3~O~8~ stoichiometry deduced from high-resolution electron microscopy images,
    Acta Crystallographica Section B 49, 951 (1993)

Band structure with spin-orbit coupling