Hf4Pd12

MatHub3d-53822-Hf4Pd12

Basic properties

Property Value
Space group (194, "'P6_3/mmc'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -92.643
Total energy / atom (eV) -5.790

Lattice Parameters(from the source)

a, b, c (Å): 5.590 5.590 9.190
α, β, γ(°): 90.0 90.0 120.0

Lattice Parameters(computed)

a, b, c (Å): 5.580 5.580 9.200
α, β, γ(°): 90.0 90.0 120.0

Energy and volume

Hf4Pd12
.
Property Value
Bulk-modulus 178.340 GPa

Density of States (DOS)







Electronic band structure (PBE)

Hf4Pd12
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-104254-Hf4Pd12