Ag3Ca3P3

MatHub3d-1031-Ag3Ca3P3

Basic properties

Property Value
Space group (189, "'P-62m'")
Magnetic False
Band gap (PBE) (eV) 0
Total energy (eV) -31.621
Total energy / atom (eV) -3.513

Lattice Parameters(from the source)

a, b, c (Å): 7.040 7.040 4.170
α, β, γ(°): 90.0 90.0 120.0

Lattice Parameters(computed)

a, b, c (Å): 7.090 7.090 4.190
α, β, γ(°): 90.0 90.0 120.0

Energy and volume

Ag3Ca3P3
.
Property Value
Bulk-modulus 63.209 GPa

Density of States (DOS)







Electronic band structure (PBE)

Ag3Ca3P3
  
Property Value
Band gap 0 eV
Band degeneracy(CBM) 0.00

Data source

Property Value
Source icsd-10016-Ag3Ca3P3