• Formula : GaCl3
  • Space Group : P-1 (2)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 6.94
    b = 6.84
    c = 6.82
    α = 119.5
    β = 90.8
    γ = 118.6
  • Number of atoms per primitive cell = 8
    Total number of electrons per primitive cell = 68
  • Band gap = 0.0 eV
    Direct Gap = 0.013 eV
    Metallicity = 0.056
    Topological Z2 indices ν = (1;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 30336

Band structure with spin-orbit coupling