Ca3BiN is a ternary ceramic compound combining calcium, bismuth, and nitrogen, representing an emerging materials class at the intersection of nitride and bismuth-containing ceramics. This is primarily a research-phase material being investigated for potential applications requiring the combined attributes of high hardness, chemical stability, and bismuth's unique electronic or radiation properties. The material family shows promise for advanced applications where conventional ceramics fall short, though industrial adoption remains limited pending further development and characterization of manufacturing processes and long-term performance.
Compliance & Regulations
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 58.63 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.1700 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 49.76 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 4.890 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 0.4310 | eV | DFT · OptB88vdW | ||
| ↳ | 0.9500 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 34.28 | - | DFT · PBE | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 14.00 | - | DFT · OptB88vdW | ||
| ↳ | 9.091 | - | DFT · TBmBJ | ||
Electronic Dielectric Tensor(ε∞) | Matrix (redacted) | - | DFT · PBE | ||
Total Dielectric Tensor(ε) | Matrix (redacted) | - | DFT · PBE | ||
Electron Effective Mass(m*e) | 0.3800 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 0.2500 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00154 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00151 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -150.7 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 136.5 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 31.48 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.198 | 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