PbIF is a lead iodide fluoride ceramic compound belonging to the family of mixed-halide perovskites and halide materials. This is primarily a research material under investigation for optoelectronic and photovoltaic applications, representing an emerging class of lead-halide compounds with potential for tunable electronic and optical properties. The material is notable in the context of next-generation solar cells and light-emitting devices where halide perovskites offer advantages in bandgap tunability and solution processability compared to traditional inorganic semiconductors.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 31.31 | GPa | DFT · OptB88vdW | ||
Exfoliation Energy(Eexf) | 55.68 | meV/atom | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2800 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 15.55 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 7.285 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 2.013 | eV | DFT · OptB88vdW | ||
| ↳ | 3.016 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 50.59 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 6.261 | - | DFT · OptB88vdW | ||
| ↳ | 5.081 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 0.4600 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 0.9700 | 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 | 0.000872 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000897 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -112.7 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 234.9 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 4.470 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.598 | 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