Ca2Mg2O12Si4

MatHub3d-25267-Ca2Mg2O12Si4

Basic properties

Property Value
Space group (15, "'C2/c'")
Magnetic False
Band gap (PBE) (eV) 4.96
Total energy (eV) -146.699
Total energy / atom (eV) -7.335

Lattice Parameters(from the source)

a, b, c (Å): 9.820 9.080 5.290
α, β, γ(°): 90.0 106.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 6.690 6.690 5.320
α, β, γ(°): 102.0 102.0 85.0

Deformation Potential

n_type (eV): -3.662
p_type (eV): 4.528

Energy and volume

Ca2Mg2O12Si4
.
Property Value
Bulk-modulus 168.807 GPa

Density of States (DOS)







Electronic band structure (PBE)

Ca2Mg2O12Si4
  
Property Value
Band gap 4.96 eV
Band degeneracy(CBM) 1.00
Band degeneracy(VBM) 1.00

Data source

Property Value
Source icsd-10225-Ca2Mg2O12Si4