• Formula : NbRh
  • Space Group : Pmma (51)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 4.51
    b = 2.813
    c = 4.808
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 4
    Total number of electrons per primitive cell = 60
  • Band gap = 0.0 eV
    Direct Gap = 0.004 eV
    Metallicity = 0.545
    Topological Z2 indices ν = (0;001)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The niobium(columbium)-rhodium binary system. II. Crystal structure relationships,
    Transactions of the Metallurgical Society of Aime 230, 1259 (1964)

Band structure with spin-orbit coupling