• Formula : MnCoO3
  • Space Group : R-3 (148)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 5.385
    b = 5.385
    c = 5.385
    α = 54.52
    β = 54.52
    γ = 54.52
  • Number of atoms per primitive cell = 10
    Total number of electrons per primitive cell = 100
  • Band gap = 0.0 eV
    Direct Gap = 0.006 eV
    Metallicity = 0.610
    Topological Z2 indices ν = (1;000)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 31854

Band structure with spin-orbit coupling