• Formula : Ge3F8
  • Space Group : P2_1/c (14)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.9793
    b = 5.081
    c = 11.8135
    α = 90.0
    β = 90.974
    γ = 90.0
  • Number of atoms per primitive cell = 22
    Total number of electrons per primitive cell = 136
  • Band gap = 4.5299 eV
    Direct Gap = 4.541 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 427896

Band structure with spin-orbit coupling