LiFe2Cl2O2 is an inorganic ceramic compound containing lithium, iron, chlorine, and oxygen—a mixed-valent iron oxide-chloride with potential electrochemical activity. This material is primarily of research interest rather than established industrial use, investigated within the battery and energy storage community for its possible application as a cathode material or electrolyte component in lithium-ion cells due to the presence of both lithium and redox-active iron. Compared to conventional layered oxide cathodes, iron-based chloride compounds offer the potential for cost reduction and alternative lithium-ion transport pathways, though commercial adoption remains limited and further development is needed to optimize electrochemical performance and cycle life.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 7,569.5 | ksi | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.3300 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 3,537.5 | ksi | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1236 | lb/in³ | 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) | 8.045 | µB | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.1408 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.277 | 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