InBi2S4Cl is a quaternary semiconductor compound combining indium, bismuth, sulfur, and chlorine elements. This material belongs to the family of mixed-metal chalcohalides and represents an experimental composition primarily of interest in solid-state physics research rather than established industrial production. The compound's potential applications lie in optoelectronic and photovoltaic device research, where the layered sulfide structure and halide doping offer opportunities for band gap engineering and charge transport optimization in next-generation semiconductor devices.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 52.17 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2700 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 27.56 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 6.079 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)3 entries | 1.575 | eV | DFT · OptB88vdW | ||
| ↳ | 2.336 | eV | DFT · TBmBJ | ||
| ↳ | 1.500 | eV | Measured | ||
Dielectric Constant (Relative Permittivity)(εr) | 52.32 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 11.28 | - | DFT · OptB88vdW | ||
| ↳ | 8.292 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 0.2567 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 1.933 | 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 | 0.00117 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00254 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -112.8 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 349.9 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 15.82 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.6240 | 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