Ir4Zr12

MatHub3d-56600-Ir4Zr12

Basic properties

Property Value
Space group (121, "'I-42m'")
Magnetic True
Magnetic moment (μB) 0.18
Band gap (PBE) (eV) 0
Total energy (eV) -135.238
Total energy / atom (eV) -8.452

Lattice Parameters(from the source)

a, b, c (Å): 10.790 10.790 5.660
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 8.130 8.130 8.130
α, β, γ(°): 97.0 97.0 139.0

Density of States (DOS)







Electronic band structure (PBE)

Ir4Zr12
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-104607-Ir4Zr12