Calcium scandium oxide (CaSc₂O₄) is an inorganic ceramic compound belonging to the rare-earth oxide family, characterized by a mixed-valence crystal structure. This material is primarily of research interest in solid-state chemistry and materials science, with potential applications in optical devices, thermal barrier coatings, and advanced ceramics where scandium-doping of calcium compounds offers improved refractory properties and thermal stability compared to undoped calcium oxides.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 3.872 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 3.466 | eV | DFT · OptB88vdW | ||
| ↳ | 4.553 | eV | DFT · TBmBJ | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 4.660 | - | DFT · OptB88vdW | ||
| ↳ | 3.522 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 1.300 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 2.743 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.000945 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000941 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -194.6 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 324.4 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 0.000 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -3.679 | 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