• Formula : Ge2Mo
  • Space Group : Pnma (62)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 6.343
    b = 3.451
    c = 8.582
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 12
    Total number of electrons per primitive cell = 88
  • Band gap = 0.0 eV
    Direct Gap = 0.026 eV
    Metallicity = 0.156
    Topological Z2 indices ν = (1;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Structure data for some arsenic- and germanium-rich compounds of molybdenum,
    Nature (London) 206, 502 (1965)

Band structure with spin-orbit coupling