• Formula : Li2RuO3
  • Space Group : C2/m (12)
    Centrosymmetric : True
    Dimensionality : 2D
  • Structure parameters
    a = 4.9116
    b = 8.7586
    c = 9.8544
    α = 90.0
    β = 100.08
    γ = 90.0
  • Number of atoms per primitive cell = 12
    Total number of electrons per primitive cell = 80
  • Band gap = 0.0 eV
    Direct Gap = 0.087 eV
    Metallicity = 0.084
    Topological Z2 indices ν = (0;001)
  • scf.in - scf.out - bands.in - bands.out
  • Reference: ICSD Collection Code: 202611

Band structure with spin-orbit coupling