Barium iodide (BaI₂) is an ionic ceramic compound consisting of barium cations and iodide anions, belonging to the halide ceramics family. While primarily used in laboratory and specialized industrial settings, BaI₂ serves roles in X-ray imaging scintillators, analytical chemistry applications, and emerging optoelectronic research where its iodide composition provides useful optical and radiation-interaction properties. The material remains largely in research and niche industrial domains rather than high-volume structural applications, making it relevant for engineers designing radiation detection systems, spectroscopy equipment, or specialized optical components requiring halide ceramics.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 23.63 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.3300 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 9.600 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 5.165 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 3.327 | eV | DFT · OptB88vdW | ||
| ↳ | 4.072 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr)3 entries | 13.65 | - | DFT · OptB88vdW | ||
| ↳ | 17.76 | - | DFT · PBE | ||
| ↳ | 8.151 range 4.596–11.71median of 2 measurements | - | DFT · PBEsol | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 4.650 | - | DFT · OptB88vdW | ||
| ↳ | 3.350 | - | DFT · TBmBJ | ||
Electronic Dielectric Tensor(ε∞) | Matrix (redacted) | - | DFT · PBE | ||
Total Dielectric Tensor(ε) | Matrix (redacted) | - | DFT · PBE | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij)2 entries | 0.02205 | C/m² | DFT · OptB88vdW | ||
| ↳ | 0.6677 | C/m² | DFT · PBE | ||
Piezoelectric Stress Tensor(eij) | Matrix (redacted) | C/m² | DFT · PBE | ||
Thermoelectric Power Factor(PF)2 entries | 0.000736 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000758 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -136 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 371.1 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 0.000 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.00120 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf)2 entries | -1.900 | eV/atom | DFT · OptB88vdW | ||
| ↳ | -2.092 | eV/atom | Measured |
Reference data from cited sources. Not verified or certified by MatWorld Inc. Verify against the source before use in design. Terms: engineering data