Ba2BiCl is an inorganic ceramic compound belonging to the halide perovskite family, composed of barium, bismuth, and chlorine elements. This material is primarily of research and exploratory interest rather than an established industrial ceramic, being investigated for potential applications in optoelectronics and solid-state physics where its crystal structure and electronic properties may offer advantages in emerging technologies. Engineers and researchers consider halide perovskites like this compound for next-generation photovoltaic devices, scintillators, and radiation detection systems due to their tunable electronic properties and potential cost advantages over traditional semiconductors, though stability and scalability remain active development areas.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 31.13 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.4200 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 12.50 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 5.908 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 0.9920 | eV | DFT · OptB88vdW | ||
| ↳ | 1.471 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 56.10 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 8.997 | - | DFT · OptB88vdW | ||
| ↳ | 7.411 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 0.4600 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 1.260 | 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 | 0.00219 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00258 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -211.1 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 374.7 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 32.70 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.06550 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.566 | 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