Sodium lithium hydride (NaLiH) is a mixed-metal hydride ceramic compound that belongs to the family of complex hydrides, which are lightweight ionic solids containing hydrogen. This material is primarily of research and development interest for energy storage and hydrogen-related applications, as complex hydrides have shown promise as hydrogen storage media and solid-state electrolytes in advanced battery systems. NaLiH represents an experimental material class where engineered combinations of alkali metals with hydrogen are being evaluated to optimize hydrogen absorption capacity, thermal stability, and electrochemical performance for next-generation energy systems.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 9.005 range 5.980–12.03median of 2 measurements | GPa | DFT · OptB88vdW | ||
Shear Modulus(G) | -2.015 range -7.080–3.050median of 2 measurements | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 761.5 range 629–894median of 2 measurements | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 0.000 | eV | DFT · OptB88vdW | ||
| ↳ | 0.000 | eV | DFT · TBmBJ | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.6044 range 0.4738–0.7350median of 2 measurements | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | 0.2457 range 0.1151–0.3763median of 2 measurements | 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