KPt2Se3 is an intermetallic compound combining potassium, platinum, and selenium, belonging to the family of ternary metal selenides. This material is primarily of research and theoretical interest rather than established commercial use, investigated for its electronic and structural properties within materials science and solid-state chemistry. Compounds in this class are explored for potential applications in thermoelectrics, catalysis, and advanced electronic devices, where the combination of noble metal (Pt) with chalcogenide chemistry offers tunable band structure and chemical reactivity.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 3,740.2 | ksi | DFT | ||
Shear Modulus(G) | 1,839.5 | ksi | DFT |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.2609 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 1.055 | eV | DFT · OptB88vdW | ||
| ↳ | 1.437 | eV | DFT · TBmBJ | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 11.81 | - | DFT · OptB88vdW | ||
| ↳ | 8.716 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 0.4633 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 1.337 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00219 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00173 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -195.9 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 322.6 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 33.19 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.6398 | 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