• Formula : CaGa2
  • Space Group : Cmmm (65)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 4.322
    b = 4.322
    c = 4.322
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 9
    Total number of electrons per primitive cell = 108
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.584
    Topological Z2 indices ν = (0;011)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 619281

Band structure with spin-orbit coupling