• Formula : Rb3Cu2Cl7
  • Space Group : Ccce (68)
    Centrosymmetric : True
    Dimensionality : 2D
  • Structure parameters
    a = 24.843
    b = 7.216
    c = 7.216
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 24
    Total number of electrons per primitive cell = 196
  • Band gap = 0.0799 eV
    Direct Gap = 0.246 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 26369

Band structure with spin-orbit coupling