• Formula : Ni7Bi3
  • Space Group : Pmma (51)
    Centrosymmetric : True
    Dimensionality : 1D
  • Structure parameters
    a = 8.1527
    b = 14.1209
    c = 5.3243
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 20
    Total number of electrons per primitive cell = 230
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.438
    Topological Z2 indices ν = (0;001)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The incommensurately modulated structure of NiBi,
    Solid State Sciences 2, 353 (2000)

Band structure with spin-orbit coupling