Ca3BiAs is an intermetallic ceramic compound combining calcium, bismuth, and arsenic in a defined stoichiometric ratio. This is a research-phase material investigated for potential semiconductor and optoelectronic applications, particularly within the broader family of bismuth-based compounds known for their unique electronic and thermal transport properties. While not yet widely deployed in commercial products, materials in this composition family are of interest for specialized applications where bismuth's high atomic number and spin-orbit coupling effects can be leveraged.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 28.40 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.3000 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 19.26 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 3.444 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)3 entries | 0.06200 | eV | DFT · OptB88vdW | ||
| ↳ | 0.6090 | eV | DFT · TBmBJ | ||
| ↳ | 0.000 | eV | Measured | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 29.01 | - | DFT · OptB88vdW | ||
| ↳ | 13.17 | - | DFT · TBmBJ | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.000229 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00127 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -55.59 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 124.4 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 19.71 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.6650 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.3483 | 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