• Formula : Pd7Se2
  • Space Group : P2_1/c (14)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 9.441
    b = 5.37
    c = 5.495
    α = 90.0
    β = 93.61
    γ = 90.0
  • Number of atoms per primitive cell = 18
    Total number of electrons per primitive cell = 276
  • Band gap = 0.0 eV
    Direct Gap = 0.020 eV
    Metallicity = 0.383
    Topological Z2 indices ν = (1;010)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 65052

Band structure with spin-orbit coupling