• Formula : SiC
  • Space Group : P6_3mc (186)
    Centrosymmetric : False
    Dimensionality : 3D
  • Structure parameters
    a = 3.081
    b = 3.081
    c = 15.1248
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 12
    Total number of electrons per primitive cell = 48
  • Band gap = 2.0119 eV
    Direct Gap = 3.126 eV
    Metallicity = 0.000
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    The 6H-SiC structure model: Further refinement from SCXRD data from a terrestrial moissanite Locality: 150 km NW from Izmir, Turkey,
    American Mineralogist 92, 403 (2007)

Band structure with spin-orbit coupling