Li3LaP2 is an inorganic ceramic compound combining lithium, lanthanum, and phosphorus, belonging to the phosphate ceramic family. This material is primarily of research interest for solid-state electrolyte and ionic conductor applications, where its lithium content and crystalline structure make it a candidate for next-generation lithium-ion battery systems and energy storage devices. The lanthanum-phosphate framework is studied for its potential to enable high ionic conductivity at moderate temperatures, positioning it as an alternative to conventional polymer and liquid electrolytes in advanced battery architectures.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 58.83 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.1900 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 49.32 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 3.460 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 0.5020 | eV | DFT · OptB88vdW | ||
| ↳ | 0.9800 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr)2 entries | 31.35 | - | DFT · PBE | ||
| ↳ | 22.65 range 13.38–31.93median of 2 measurements | - | DFT · PBEsol | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 13.94 | - | DFT · OptB88vdW | ||
| ↳ | 10.98 | - | DFT · TBmBJ | ||
Electronic Dielectric Tensor(ε∞) | Matrix (redacted) | - | DFT · PBE | ||
Total Dielectric Tensor(ε) | Matrix (redacted) | - | DFT · PBE | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 31.78 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.105 | 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