• Formula : YGa2Ni
  • Space Group : Cmcm (63)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.131
    b = 10.05
    c = 6.62
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 8
    Total number of electrons per primitive cell = 94
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.900
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Intermetallic compounds R Ga2 Ni and R Ga4 Ni in (Y, Sm, Gd, Tb, Ho, Er, Tm, Yb, Lu) - Ga - Ni systems,
    Izvestiya Akademii Nauk SSSR, Metally 1981, 228 (1981)

Band structure with spin-orbit coupling