WCl₆ (tungsten hexachloride) is a halide compound of tungsten that exists as a volatile crystalline solid at room temperature. It is primarily encountered in research, materials processing, and semiconductor manufacturing contexts rather than as a structural or bulk engineering material. WCl₆ serves as a precursor chemical for chemical vapor deposition (CVD) and other thin-film synthesis routes to produce tungsten-containing coatings, contacts, and interconnects; it is also used in organometallic synthesis and as a catalyst or catalyst precursor in specialized chemical processes. Engineers would select WCl₆ when high-purity tungsten deposition, precise stoichiometric control in film growth, or specific chemical reactivity is required—applications where its volatility and reactivity are advantageous rather than limiting factors.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 1,760.8 | ksi | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2400 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 1,164.7 | ksi | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1340 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 1.392 | eV | DFT · OptB88vdW | ||
| ↳ | 2.028 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 4.940 | - | DFT · PBE | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 7.300 | - | DFT · OptB88vdW | ||
| ↳ | 6.048 | - | DFT · TBmBJ | ||
Electronic Dielectric Tensor(ε∞) | Matrix (redacted) | - | DFT · PBE | ||
Total Dielectric Tensor(ε) | Matrix (redacted) | - | DFT · PBE | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.000696 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000608 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -250.9 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 365.9 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 22.38 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf)2 entries | -0.9481 | eV/atom | DFT · OptB88vdW | ||
| ↳ | -0.8482 | eV/atom | Measured |
Reference data from cited sources. Not verified or certified by MatWorld Inc. Verify against the source before use in design. Terms: engineering data