As2Pb4Pd6

MatHub3d-5776-As2Pb4Pd6

Basic properties

Property Value
Space group (36, "'Cmc2_1'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -47.632
Total energy / atom (eV) -3.969

Lattice Parameters(from the source)

a, b, c (Å): 11.860 6.860 5.810
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 6.880 6.880 5.950
α, β, γ(°): 90.0 90.0 59.0

Energy and volume

As2Pb4Pd6
.
Property Value
Bulk-modulus 93.170 GPa

Density of States (DOS)







Electronic band structure (PBE)

As2Pb4Pd6
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-106267-As2Pb4Pd6