Pt12Ta4

MatHub3d-72271-Pt12Ta4

Basic properties

Property Value
Space group (11, "'P2_1/m'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -99.457
Total energy / atom (eV) -6.216

Lattice Parameters(from the source)

a, b, c (Å): 4.870 5.540 9.270
α, β, γ(°): 90.0 101.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 4.900 5.560 9.340
α, β, γ(°): 90.0 101.0 90.0

Energy and volume

Pt12Ta4
.
Property Value
Bulk-modulus 261.877 GPa

Density of States (DOS)







Electronic band structure (PBE)

Pt12Ta4
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-105804-Pt12Ta4