Al2C2N2O10

MatHub3d-2451-Al2C2N2O10

Basic properties

Property Value
Space group (63, "'Cmcm'")
Magnetic True
Magnetic moment (μB) 11.99
Band gap (PBE) (eV) 0.37
Total energy (eV) -97.177
Total energy / atom (eV) -6.074

Lattice Parameters(from the source)

a, b, c (Å): 6.620 11.940 5.720
α, β, γ(°): 90.0 90.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 7.400 7.400 6.100
α, β, γ(°): 90.0 90.0 122.0

Deformation Potential

n_type (eV): -10.225
p_type (eV): -12.568

Density of States (DOS)







Electronic band structure (PBE)

Al2C2N2O10
  
Property Value
Band gap 0.37 eV
Band degeneracy(CBM) 1.00
Band degeneracy(VBM) 1.00

Data source

Property Value
Source icsd-10027-Al2C2N2O10