• Formula : SnWO4
  • Space Group : Pnna (52)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 5.627
    b = 11.6486
    c = 4.9973
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 24
    Total number of electrons per primitive cell = 264
  • Band gap = 1.3217 eV
    Direct Gap = 1.354 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Alpha stannous tungstate: Properties, crystal structure and relationship to ferroelectric SbTaO4 type compounds,
    Acta Crystallographica, Section B 30, 2088 (1974)

Band structure with spin-orbit coupling