• Formula : Ni3TeO6
  • Space Group : P1 (1)
    Centrosymmetric : False
    Dimensionality : Unknown
  • Structure parameters
    a = 5.1087
    b = 5.1087
    c = 13.767
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 10
    Total number of electrons per primitive cell = 72
  • Band gap = 0.0 eV
    Direct Gap = 0.001 eV
    Metallicity = 0.376
    Topological Z2 indices ν = ?
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 240377

Band structure with spin-orbit coupling