Cu3PSe2S2 is a quaternary chalcogenide compound combining copper with phosphorus, selenium, and sulfur—a mixed-anion semiconductor material in the emerging class of multinary metal chalcogenides. This is primarily a research-phase material under investigation for optoelectronic and thermoelectric applications, rather than an established industrial product; the material family shows promise for photovoltaic absorbers, solid-state radiation detection, and energy conversion devices where tunable bandgap and mixed-anion chemistry offer advantages over conventional binary or ternary semiconductors.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 4.794 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 0.2890 | eV | DFT · OptB88vdW | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.01260 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.2178 | 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