• Formula : GaPd2
  • Space Group : Pnma (62)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 5.493
    b = 4.064
    c = 7.814
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 12
    Total number of electrons per primitive cell = 196
  • Band gap = 0.0 eV
    Direct Gap = 0.001 eV
    Metallicity = 0.484
    Topological Z2 indices ν = (0;011)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Zum Aufbau der Systeme Co-Ga, Pd-Ga, Pd-Sn und verwandter Legierungen,
    Zeitschrift fuer Metallkunde 50, 534 (1959)

Band structure with spin-orbit coupling