F5Li3OV
F5Li3OV is a semiconducting lithium-vanadium oxyfluoride that demonstrates high potential for experimental synthesis and material development.
About F5Li3OV
F5Li3OV is a complex lithium-based compound incorporating fluorine, oxygen, and vanadium. Its semiconducting electronic character suggests potential utility in specialized electronic or electrochemical applications where controlled conductivity is required.
As a near-hull material, this compound is considered thermodynamically stable and likely synthesizable under appropriate laboratory conditions. With multiple documented structural configurations, it represents a versatile subject for ongoing research in solid-state chemistry.
Key Properties
Cross-validated computational properties for F5Li3OV, aggregated across 3 databases.
Band GapEnergy needed to move an electron from the valence band to the conduction band. Lower or zero values tend to behave more metallic; larger gaps are more insulating or semiconducting.
Energy Above HullThermodynamic distance from the most stable set of competing phases. 0 eV/atom is on the convex hull; small positive values may still be experimentally accessible.
StabilityA plain-language summary of the best reported energy-above-hull result. It reflects whether the lowest-energy structure is on, near, or far from the stability hull.
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
Reported Structures
Lowest-energy structures reported for F5Li3OV, ranked by energy above hull.
| Space GroupSymmetry classification of the crystal arrangement. The number is the international space-group index. | Crystal SystemBroad lattice family, such as cubic, tetragonal, monoclinic, or triclinic, derived from unit-cell symmetry. | Band Gap (eV)Electronic gap calculated for this specific reported structure, measured in electronvolts. | E above hull (eV/atom)Thermodynamic distance from the convex hull for this structure, normalized per atom. Lower is generally more stable. | E/atom (eV)Computed total energy normalized per atom. Use energy above hull, not this value alone, when comparing stability. | Density (g/cm³)Mass per relaxed crystal volume, reported in grams per cubic centimeter. |
|---|---|---|---|---|---|
| P1 (No. 1) | triclinic | 2.16 | 0.0196 | -5.975 | 2.84 |
| Pc (No. 7) | monoclinic | 2.79 | 0.0291 | -5.965 | 2.94 |
| Imm2 (No. 44) | orthorhombic | 2.99 | 0.0959 | -5.898 | 2.37 |
| P1 (No. 1) | triclinic | 0.00 | 1.5768 | -4.418 | 2.84 |
| Imm2 (No. 44) | — | — | — | — | — |
| Pc (No. 7) | — | — | — | — | — |
| — | — | — | — | — | 2.52 |
Applications
Where F5Li3OV is used.
Frequently Asked Questions
Common questions about F5Li3OV, answered from cross-validated data.
What is F5Li3OV?
F5Li3OV is a semiconducting lithium-vanadium oxyfluoride that demonstrates high potential for experimental synthesis and material development.
What is F5Li3OV used for?
What is the band gap of F5Li3OV?
Is F5Li3OV a metal, semiconductor, or insulator?
Is F5Li3OV thermodynamically stable?
What is the crystal structure of F5Li3OV?
What is the density of F5Li3OV?
How many polymorphs of F5Li3OV are known?
What elements does F5Li3OV contain?
Where does the data for F5Li3OV come from?
How It Compares
As a unique lithium-vanadium oxyfluoride, this compound serves as an interesting case study in multi-anion material design, offering a distinct structural profile compared to simpler binary or ternary lithium salts.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
- omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
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