LiAcO3 (lithium acetate oxide) is an experimental ionic compound combining lithium with acetate-based chemistry, positioned as an emerging semiconductor material rather than a conventional commercial semiconductor. Research interest in this material likely stems from its potential in lithium-ion transport applications and solid-state ionic conductivity, making it relevant to energy storage research communities exploring alternatives to conventional electrolyte and cathode materials. While not yet widely deployed in production, compounds in the lithium-acetate family are being investigated for next-generation battery architectures, solid electrolytes, and electrochemical device applications where ionic mobility and chemical stability are critical.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 123.7 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.3900 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 30.18 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 7.893 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)3 entries | 2.806 | eV | DFT · PBE | ||
| ↳ | 0.000 | eV | DFT · OptB88vdW | ||
| ↳ | 0.000 | eV | DFT · TBmBJ | ||
Magnetic Moment(μB)2 entries | 0.000 | μB | DFT | ||
| ↳ | 1.999 | µB | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.1722 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf)2 entries | -2.369 | eV/atom | DFT | ||
| ↳ | -2.271 | 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