• Formula : CuWO4
  • Space Group : P-1 (2)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 4.8352
    b = 6.0538
    c = 4.9429
    α = 93.26
    β = 94.25
    γ = 80.11
  • Number of atoms per primitive cell = 12
    Total number of electrons per primitive cell = 126
  • Band gap = 0.0 eV
    Direct Gap = 0.008 eV
    Metallicity = 0.766
    Topological Z2 indices ν = (0;010)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 169004

Band structure with spin-orbit coupling