CaAl₂Se₄ is a calcium aluminium selenide compound belonging to the chalcogenide semiconductor family. This material is primarily of research interest rather than established commercial use, with potential applications in optoelectronic devices and photovoltaic systems where its semiconductor properties could be exploited. The compound represents an experimental alternative within the broader class of II-IV-VI semiconductors, investigated for specialized optical and electronic applications where selenium-based compounds offer advantages in bandgap engineering and light absorption characteristics.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1390 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 2.972 | eV | DFT · OptB88vdW | ||
| ↳ | 3.794 | eV | DFT · TBmBJ | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 6.411 | - | DFT · OptB88vdW | ||
| ↳ | 5.306 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 0.6967 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 0.9500 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00200 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00251 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -257.9 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 292.1 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 0.2800 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.292 | 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