MgCu2SiS4 is a quaternary semiconductor compound combining magnesium, copper, silicon, and sulfur—a member of the sulfide semiconductor family with potential for photovoltaic and optoelectronic applications. This material remains largely in the research phase, explored primarily for thin-film solar cells and light-emitting devices due to its tunable bandgap and earth-abundant constituent elements. Engineers investigating cost-effective alternatives to conventional II-VI or III-V semiconductors may consider this compound family, particularly where non-toxicity and material availability are design constraints.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 72.50 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.3300 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 28.82 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 3.377 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)3 entries | 3.200 | eV | Measured | ||
| ↳ | 1.688 | eV | DFT · OptB88vdW | ||
| ↳ | 2.143 | eV | DFT · TBmBJ | ||
High-Frequency Dielectric Constant (ε∞)(ε∞) | 5.876 | - | DFT · TBmBJ | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 19.88 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.00450 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.7973 | 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