• Formula : Ti5Sb2Rh
  • Space Group : I4/mcm (140)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 10.486
    b = 10.486
    c = 5.314
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 16
    Total number of electrons per primitive cell = 174
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.596
    Topological Z2 indices ν = (1;111)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Ternary transition metal antimonides T5 T'1-x Sb2+x (T = Ti, Zr, Hf; T' = Fe, Co, Ni, Cu, Ru, Rh, Pd, Cd) with Nb5 Si Sn2 (ordered W5 Si3, filled V4 Si Sb2) type structure,
    Zeitschrift fuer Anorganische und Allgemeine Chemie 628, 337 (2002)

Band structure with spin-orbit coupling