PrTlSe2 is a ternary semiconductor compound composed of praseodymium, thallium, and selenium, belonging to the rare-earth chalcogenide family of materials. This is a research-phase compound with limited industrial deployment; it is primarily investigated in materials science for potential applications in infrared optics, thermoelectric devices, and solid-state electronics where rare-earth semiconductors offer unique electronic band structures and optical properties. The material's combination of a rare-earth element with heavy chalcogens positions it as a candidate for exploring novel properties in niche photonic and quantum applications, though alternative rare-earth or lead-based semiconductors currently dominate commercial markets.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 40.28 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2600 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 24.57 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 6.669 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)3 entries | 1.180 | eV | Measured | ||
| ↳ | 1.227 | eV | DFT · OptB88vdW | ||
| ↳ | 1.640 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 23.40 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 8.597 | - | DFT · OptB88vdW | ||
| ↳ | 7.193 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 2.113 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 0.3033 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.000 | C/m² | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00331 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000618 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -295.2 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 97.81 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 30.38 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.423 | 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