• Formula : Sr2Fe2O5
  • Space Group : Ima2 (46)
    Centrosymmetric : False
    Dimensionality : 3D
  • Structure parameters
    a = 5.661
    b = 15.598
    c = 5.531
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 18
    Total number of electrons per primitive cell = 132
  • Band gap = 0.0 eV
    Direct Gap = 0.001 eV
    Metallicity = 0.480
    Topological Z2 indices ν = ?
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Darstellung und Untersuchung von Sr2 Fe2 O5-Einkristallen. Ein Beitrag zur Kristallchemie von M2 Fe2 O5-Verbindungen,
    Zeitschrift fuer Anorganische und Allgemeine Chemie 464, 169 (1980)

Band structure with spin-orbit coupling