TaCu₃Se₃S is an experimental ternary compound combining tantalum, copper, selenium, and sulfur—a mixed chalcogenide system that bridges metallic and semiconducting character. This material remains primarily a research compound; its potential lies in thermoelectric and optoelectronic applications where copper-based chalcogenides and tantalum-containing phases have shown promise for solid-state energy conversion and photovoltaic studies.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.2160 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 1.728 | eV | DFT · OptB88vdW | ||
| ↳ | 1.787 | eV | DFT · TBmBJ | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 8.600 | - | DFT · OptB88vdW | ||
| ↳ | 7.768 | - | DFT · TBmBJ | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 27.56 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.5491 | 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