Fe2Zr6

MatHub3d-46749-Fe2Zr6

Basic properties

Property Value
Space group (63, "'Cmcm'")
Magnetic True
Magnetic moment (μB) 3.46
Band gap (PBE) (eV) 0
Total energy (eV) -60.090
Total energy / atom (eV) -7.511

Lattice Parameters(from the source)

a, b, c (Å): 3.320 10.970 8.820
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 5.890 5.890 9.000
α, β, γ(°): 90.0 90.0 147.0

Density of States (DOS)







Electronic band structure (PBE)

Fe2Zr6
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-106700-Fe2Zr6