N2O8Te2

MatHub3d-64905-N2O8Te2

Basic properties

Property Value
Space group (2, "'P-1'")
Magnetic True
Magnetic moment (μB) 6.00
Band gap (PBE) (eV) 0.47
Total energy (eV) -55.880
Total energy / atom (eV) -4.657

Lattice Parameters(from the source)

a, b, c (Å): 5.150 6.870 7.100
α, β, γ(°): 116.0 109.0 93.0

Lattice Parameters(computed)

a, b, c (Å): 5.360 7.020 6.590
α, β, γ(°): 123.0 119.0 83.0

Deformation Potential

n_type (eV): -15.127
p_type (eV): -10.690

Energy and volume

N2O8Te2
.
Property Value
Bulk-modulus 95.114 GPa

Density of States (DOS)







Electronic band structure (PBE)

N2O8Te2
  
Property Value
Band gap 0.47 eV
Band degeneracy(CBM) 0.00
Band degeneracy(VBM) 0.00

Electric transport properties

n-type Seebeck coefficient (700K)



p-type Seebeck coefficient (700K)
n-type conductivity (700K)



p-type conductivity (700K)
n-type power factor (700K)



p-type power factor (700K)

Data source

Property Value
Source icsd-10445-N2O8Te2