NaCuO2 is a layered sodium copper oxide ceramic compound that belongs to the class of mixed-valence transition metal oxides. This material exhibits interesting electrochemical and structural properties typical of copper oxide systems, making it a subject of research in energy storage and catalysis applications. While primarily investigated at the laboratory scale rather than widely deployed industrially, NaCuO2 and related sodium-copper oxide phases are of interest for battery cathode materials, heterogeneous catalysts, and functional ceramic applications where copper's variable oxidation states can be exploited.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K)2 entries | 9,142.1 | ksi | DFT | ||
| ↳ | 12,397.8 | ksi | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2900 | - | DFT · OptB88vdW | ||
Shear Modulus(G)2 entries | 4,497.1 | ksi | DFT | ||
| ↳ | 6,449.8 | ksi | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1467 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 0.5640 | eV | DFT · OptB88vdW | ||
| ↳ | 0.6340 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr)3 entries | 14.44 | - | DFT · OptB88vdW | ||
| ↳ | 9.150 | - | DFT · PBE | ||
| ↳ | 6.102 range 4.664–7.540median of 2 measurements | - | DFT · PBEsol | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 7.130 | - | DFT · OptB88vdW | ||
| ↳ | 5.779 | - | DFT · TBmBJ | ||
Electronic Dielectric Tensor(ε∞) | Matrix (redacted) | - | DFT · PBE | ||
Total Dielectric Tensor(ε) | Matrix (redacted) | - | DFT · PBE | ||
Electron Effective Mass(m*e) | 0.3533 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 0.3700 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij)2 entries | 0.000 | C/m² | DFT · OptB88vdW | ||
| ↳ | 0.8329 | C/m² | DFT · PBE | ||
Piezoelectric Stress Tensor(eij) | Matrix (redacted) | C/m² | DFT · PBE | ||
Thermoelectric Power Factor(PF)2 entries | 0.00241 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000738 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -289.4 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 358.1 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 20.76 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.05970 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.093 | eV/atom | DFT · OptB88vdW |
Reference data from cited sources. Not verified or certified by MatWorld Inc. Verify against the source before use in design. Terms: engineering data