Ba2CuCN2O2 is an oxycyanide ceramic compound containing barium, copper, carbon, and nitrogen. This is a research-phase material from the complex metal oxycyanide family, which has attracted interest in solid-state chemistry for potential applications in ion conductivity and electronic properties. The material's notable feature is its mixed-anion coordination structure (combining oxide and cyanide ligands), which distinguishes it from conventional metal oxides and may enable tunable properties for specialized electronic or catalytic applications.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1861 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 0.000 | eV | DFT · OptB88vdW | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 6.600e-7 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 5.600e-7 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | 22.62 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 22.57 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.09900 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.383 | 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