Cr8Zr4

MatHub3d-36017-Cr8Zr4

Basic properties

Property Value
Space group (194, "'P6_3/mmc'")
Magnetic True
Magnetic moment (μB) 3.69
Band gap (PBE) (eV) 0
Total energy (eV) -76.972
Total energy / atom (eV) -6.414

Lattice Parameters(from the source)

a, b, c (Å): 5.100 5.100 8.270
α, β, γ(°): 90.0 90.0 120.0

Lattice Parameters(computed)

a, b, c (Å): 5.130 5.130 8.120
α, β, γ(°): 90.0 90.0 120.0

Density of States (DOS)







Electronic band structure (PBE)

Cr8Zr4
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-102862-Cr8Zr4