ZnCu3H6Cl2O6 is a copper-zinc oxyhydroxide chloride ceramic compound, likely a layered hydroxide or mixed-metal oxide phase used in research contexts. This material belongs to the family of mixed-valent transition metal ceramics and oxysalts, which are of interest for catalytic, photocatalytic, and ion-exchange applications due to their tunable crystal structure and surface chemistry. The zinc-copper combination provides potential for enhanced catalytic activity or selective ion sorption, making it attractive in environmental remediation, water treatment, and emerging green chemistry processes where traditional materials show limitations.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 7,485.4 | ksi | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2900 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 3,502.7 | ksi | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1299 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 0.2480 | eV | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞) | 20.32 | - | DFT · OptB88vdW | ||
Electron Effective Mass(m*e) | 0.02000 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 0.02000 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 2.916 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.0000750 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000368 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -135.6 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 89.40 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.02560 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.9103 | 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