• Formula : SnRh
  • Space Group : P2_13 (198)
    Centrosymmetric : False
    Dimensionality : 3D
  • Structure parameters
    a = 5.132
    b = 5.132
    c = 5.132
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 8
    Total number of electrons per primitive cell = 124
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.365
    Topological Z2 indices ν = (0;100)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Untersuchungen im System Rh-Sn,
    Zeitschrift fuer Naturforschung, Teil A. Physikalische Chemie, Kosmophysik (2,1947-32,1977) 2, 120 (1947)

Band structure with spin-orbit coupling

Wannier charge center (WCC) at six time-reversal invariant planes