• Formula : RuOF4
  • Space Group : P2_1/c (14)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 6.0602
    b = 8.3614
    c = 6.2631
    α = 90.0
    β = 91.638
    γ = 90.0
  • Number of atoms per primitive cell = 24
    Total number of electrons per primitive cell = 200
  • Band gap = 0.4136 eV
    Direct Gap = 0.428 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 417249

Band structure with spin-orbit coupling