HoTlS₂ is a rare-earth thallium sulfide ceramic compound combining holmium and thallium in a sulfide matrix, representing an experimental material in the family of chalcogenide ceramics. This material is primarily of research interest for potential applications in solid-state electronics, photonics, and thermal management systems where the unique electronic properties of rare-earth chalcogenides may offer advantages over conventional ceramics. Engineers would consider this compound in specialized applications requiring specific bandgap engineering or thermal transport properties, though its practical use remains limited to laboratory and development environments given the toxicity and reactivity concerns associated with thallium-containing systems.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 51.04 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2600 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 30.87 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 6.964 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 1.544 | eV | DFT · OptB88vdW | ||
| ↳ | 2.244 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 27.19 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 7.701 | - | DFT · OptB88vdW | ||
| ↳ | 6.211 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 0.9967 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 0.4700 | 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 | 0.00248 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000842 | 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 | ||
| ↳ | 122.2 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 17.76 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.623 | 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