MoW₃Se₆S₂ is a mixed-metal chalcogenide compound containing molybdenum, tungsten, selenium, and sulfur, belonging to the family of transition metal dichalcogenides and polychalcogenides. This is a research-phase material primarily investigated for its layered crystal structure and electronic properties, with potential applications in catalysis, energy storage, and two-dimensional materials research. The material's multi-element composition enables tuning of band gaps and active sites compared to single-element dichalcogenides, making it a candidate for electrochemical applications where interface chemistry is critical.
Compliance & Regulations
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 802.1 | ksi | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.3700 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 223.4 | ksi | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.2162 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 0.4840 | eV | DFT · OptB88vdW | ||
| ↳ | 0.7640 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 11.90 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 10.88 | - | DFT · OptB88vdW | ||
| ↳ | 9.020 | - | DFT · TBmBJ | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.07139 | C/m² | DFT · OptB88vdW | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 25.69 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.1045 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.6339 | 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