• Formula : Y4Ni13C4
  • Space Group : Cmmm (65)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 12.088
    b = 11.707
    c = 3.893
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 21
    Total number of electrons per primitive cell = 190
  • Band gap = 0.0 eV
    Direct Gap = 0.002 eV
    Metallicity = 0.460
    Topological Z2 indices ν = (1;110)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 618594

Band structure with spin-orbit coupling