Tl₂SiS₃ is an inorganic ceramic compound belonging to the thallium silicate sulfide family, combining thallium, silicon, and sulfur in a ternary structure. This material is primarily of research and development interest rather than established in widespread industrial production, with potential applications in infrared optics, solid-state lighting, and advanced semiconductor contexts where its optical and electronic properties may offer advantages. Engineers would consider this compound for niche photonic or sensing applications where its specific band gap, refractive index, and thermal stability characteristics provide benefits over conventional oxides or binary sulfides, though availability and processing maturity remain considerations.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 21.46 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.3200 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 10.33 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 5.514 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 2.052 | eV | DFT · OptB88vdW | ||
| ↳ | 2.685 | eV | DFT · TBmBJ | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 7.248 | - | DFT · OptB88vdW | ||
| ↳ | 5.589 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 0.7133 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 1.783 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00224 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00183 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -243.6 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 273.2 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 9.110 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.6464 | 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