Calcium iodide (CaI2) is an ionic ceramic compound belonging to the halide family, characterized by its layered crystal structure and moderate mechanical stiffness. While not widely used in traditional structural applications, CaI2 is primarily employed in specialized domains including hygroscopic desiccants, X-ray imaging scintillators, and emerging two-dimensional materials research; its notable layered structure and exfoliation behavior make it a candidate material for nanosheet production and thin-film device applications in advanced electronics and photonics.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 2,152.4 | ksi | DFT · OptB88vdW | ||
Exfoliation Energy(Eexf) | 82.42 | meV/atom | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2700 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 1,269.1 | ksi | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1464 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)4 entries | 5.980 | eV | Measured | ||
| ↳ | 3.446 | eV | DFT · OptB88vdW | ||
| ↳ | 4.374 | eV | DFT · TBmBJ | ||
| ↳ | 4.630 | eV | DFT · HSE06 | ||
Dielectric Constant (Relative Permittivity)(εr) | 6.805 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 4.213 | - | DFT · OptB88vdW | ||
| ↳ | 3.708 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 1.703 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 1.383 | 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 | 0.00342 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00117 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -302.3 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 235.2 | 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) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf)2 entries | -1.716 | eV/atom | DFT · OptB88vdW | ||
| ↳ | -1.855 | 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