Pt4Ta2

MatHub3d-72218-Pt4Ta2

Basic properties

Property Value
Space group (63, "'Cmcm'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -40.677
Total energy / atom (eV) -6.780

Lattice Parameters(from the source)

a, b, c (Å): 8.400 4.790 4.740
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 4.860 4.860 4.800
α, β, γ(°): 90.0 90.0 59.0

Energy and volume

Pt4Ta2
.
Property Value
Bulk-modulus 253.316 GPa

Density of States (DOS)







Electronic band structure (PBE)

Pt4Ta2
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-105802-Pt4Ta2