Na2LiAlF6 is a mixed-metal fluoride compound belonging to the class of fluoride salts, combining sodium, lithium, and aluminum fluoride constituents. This material is primarily investigated for use in molten salt systems, particularly in advanced nuclear reactor coolants (such as molten salt reactor designs) and as an electrolyte component in high-temperature electrochemical processes, where its thermal stability and ionic conductivity are advantageous. Compared to single-component fluoride salts, this ternary composition offers tuned melting behavior and chemical compatibility characteristics relevant to next-generation energy technologies.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 3.031 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 7.737 | eV | DFT · OptB88vdW | ||
Dielectric Constant (Relative Permittivity)(εr) | 7.831 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞) | 1.937 | - | DFT · OptB88vdW | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.000 | C/m² | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00126 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.000248 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -170.1 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 512.5 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.00200 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -3.370 | 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