Mo₃Se₂S₄ is a mixed chalcogenide compound combining molybdenum with selenium and sulfur, belonging to the family of transition metal chalcogenides. This is primarily a research material under active investigation for semiconductor and photocatalytic applications, rather than an established industrial material. The mixed anionic composition offers tunable electronic properties and enhanced catalytic activity compared to binary molybdenum chalcogenides, making it of particular interest for energy conversion and environmental remediation technologies.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 3.784 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 0.8310 | eV | DFT · OptB88vdW | ||
Dielectric Constant (Relative Permittivity)(εr) | 443.2 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞) | 10.20 | - | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.1518 | C/m² | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.03760 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.8273 | 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