• Formula : Mg2Ga
  • Space Group : P-62c (190)
    Centrosymmetric : False
    Dimensionality : 3D
  • Structure parameters
    a = 7.794
    b = 7.794
    c = 6.893
    α = 90.0
    β = 90.0
    γ = 120.0
  • Number of atoms per primitive cell = 18
    Total number of electrons per primitive cell = 198
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.702
    Topological Z2 indices ν = ?
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Kristallstrukturen von Mg2 Ga und Mg2 Tl,
    Journal of the Less-Common Metals 20, 215 (1970)

Band structure with spin-orbit coupling