• Formula : MnVAs
  • Space Group : P4/nmm (129)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 3.722
    b = 3.722
    c = 6.483
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 6
    Total number of electrons per primitive cell = 66
  • Band gap = 0.0 eV
    Direct Gap = 0.000 eV
    Metallicity = 0.580
    Topological Z2 indices ν = (1;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Nouveaux composes ternaires MM'P et MM'As. Interactions metalliques et structures,
    Materials Research Bulletin 7, 813 (1972)

Band structure with spin-orbit coupling