Ca4Sb2S is a ternary ceramic compound composed of calcium, antimony, and sulfur, belonging to the family of sulfide ceramics with mixed-metal compositions. This material is primarily of research interest for thermoelectric and solid-state applications, where its crystal structure and electronic properties are being investigated for potential use in energy conversion devices. The compound represents an emerging area of materials science focused on developing alternative thermoelectric materials with earth-abundant elements, though industrial-scale applications remain limited at this stage.
Compliance & Regulations
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1337 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 1.141 | eV | DFT · OptB88vdW | ||
| ↳ | 1.574 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 50.51 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 10.06 | - | DFT · OptB88vdW | ||
| ↳ | 8.203 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 2.557 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 0.5300 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.1042 | C/m² | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00144 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00138 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -354.5 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 196.2 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 31.25 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.01370 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.412 | 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