TiFeSe is an intermetallic compound combining titanium, iron, and selenium, belonging to the family of ternary transition-metal chalcogenides. This material is primarily of research interest rather than established in commercial production, with potential applications in thermoelectric and energy conversion technologies where the combination of metallic and semiconducting character can be exploited. Engineers would consider TiFeSe-based materials for emerging applications requiring efficient heat-to-electricity conversion or as precursor phases in advanced functional materials, though material maturity and reproducibility remain limiting factors compared to well-established alternatives.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 22,814.4 | ksi | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.3000 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 10,625.5 | ksi | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.2477 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 1.025 | eV | DFT · OptB88vdW | ||
Dielectric Constant (Relative Permittivity)(εr)2 entries | 39.19 | - | DFT · OptB88vdW | ||
| ↳ | 29.24 range 20.96–37.52median of 2 measurements | - | DFT · PBEsol | ||
High-Frequency Dielectric Constant (ε∞)(ε∞) | 22.49 | - | DFT · OptB88vdW | ||
Electron Effective Mass(m*e) | 0.9200 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 1.330 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.7660 | C/m² | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00274 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00324 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -294.1 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 390.8 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.1615 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.6368 | 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