KCrP₂S₇ is a mixed-metal thiophosphate compound combining chromium, potassium, phosphorus, and sulfur—a class of materials primarily explored in solid-state chemistry and materials research rather than established industrial production. This compound belongs to the family of sulfidic phosphates, which are investigated for potential applications in ion-conduction, catalysis, and energy storage due to their layered crystal structures and variable oxidation states. While not yet a mainstream engineering material, thiophosphates like KCrP₂S₇ represent an emerging research direction for researchers developing next-generation solid electrolytes, heterogeneous catalysts, and advanced ceramics where sulfur-based frameworks may offer advantages over oxide analogues.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 3,768.1 | ksi | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2800 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 2,133.5 | ksi | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.08826 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 1.153 | eV | DFT · OptB88vdW | ||
Dielectric Constant (Relative Permittivity)(εr) | 43.55 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞) | 28.21 | - | DFT · OptB88vdW | ||
Magnetic Moment(μB) | 3.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.2136 | C/m² | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.000749 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000327 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -224.6 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 299 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.5998 | 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