ZrH₆O₃F₄ is an experimental mixed-anion ceramic compound containing zirconium with hydride, oxide, and fluoride ligands. This material belongs to the family of complex metal hydride-fluoride ceramics, which are primarily of research interest for exploring novel ionic conductivity, thermal, and mechanical properties in solid-state chemistry. While not yet established in mainstream engineering applications, compounds of this type are investigated for potential roles in advanced electrolytes, thermal barriers, and specialty refractory applications where unusual anion combinations might confer advantageous properties.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 0.1051 | lb/in³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 5.429 | eV | DFT · OptB88vdW | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -2.056 | 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