• Formula : Na2Pd(SeO4)2
  • Space Group : P-1 (2)
    Centrosymmetric : True
    Dimensionality : 2D
  • Structure parameters
    a = 4.9349
    b = 5.9981
    c = 7.1512
    α = 73.894
    β = 86.124
    γ = 70.834
  • Number of atoms per primitive cell = 13
    Total number of electrons per primitive cell = 96
  • Band gap = 1.7145 eV
    Direct Gap = 1.715 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 249506

Band structure with spin-orbit coupling