• Formula : Y6PdBr10
  • Space Group : P-1 (2)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 9.001
    b = 9.0141
    c = 7.227
    α = 97.123
    β = 105.963
    γ = 108.538
  • Number of atoms per primitive cell = 17
    Total number of electrons per primitive cell = 154
  • Band gap = 0.498 eV
    Direct Gap = 0.589 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 424467

Band structure with spin-orbit coupling