Li5Nb2Ni3O10
Li5Nb2Ni3O10 is a metastable, semiconducting lithium transition-metal oxide used in materials science research for its complex structural properties.
About Li5Nb2Ni3O10
Li5Nb2Ni3O10 belongs to the family of layered lithium transition-metal oxides, a class of materials defined by their complex structural arrangements and potential for ion mobility. As a semiconducting oxide, it represents a unique intersection of lithium-rich chemistry and transition-metal coordination, offering a distinct electronic profile compared to more conventional battery materials.
Because this compound is classified as metastable, it is a subject of significant interest for researchers investigating structural evolution and phase stability in solid-state systems. Its existence within multiple structural databases highlights its importance in the ongoing exploration of novel oxide frameworks for electrochemical applications.
Key Properties
Cross-validated computational properties for Li5Nb2Ni3O10, 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 Li5Nb2Ni3O10, 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. |
|---|---|---|---|---|---|
| P-1 (No. 2) | triclinic | 0.42 | 0.0886 | -7.037 | 4.82 |
| P-1 (No. 2) | Triclinic | — | — | — | 4.82 |
| P-1 (No. 2) | Triclinic | — | — | — | 5.04 |
| P-1 (No. 2) | Triclinic | — | — | — | 4.95 |
| — | — | — | — | — | 4.82 |
| — | — | — | — | — | 4.82 |
Applications
Where Li5Nb2Ni3O10 is used.
Frequently Asked Questions
Common questions about Li5Nb2Ni3O10, answered from cross-validated data.
What is Li5Nb2Ni3O10?
Li5Nb2Ni3O10 is a metastable, semiconducting lithium transition-metal oxide used in materials science research for its complex structural properties.
What is Li5Nb2Ni3O10 used for?
What is the band gap of Li5Nb2Ni3O10?
Is Li5Nb2Ni3O10 a metal, semiconductor, or insulator?
Is Li5Nb2Ni3O10 thermodynamically stable?
What is the crystal structure of Li5Nb2Ni3O10?
What is the density of Li5Nb2Ni3O10?
How many polymorphs of Li5Nb2Ni3O10 are known?
What elements does Li5Nb2Ni3O10 contain?
Where does the data for Li5Nb2Ni3O10 come from?
How It Compares
Within the layered lithium transition-metal oxides class.
Within the broader class of layered lithium transition-metal oxides, Li5Nb2Ni3O10 occupies a specialized niche compared to widely commercialized cathodes like LiCoO2 or LiMn2O4. While those materials are optimized for stable, long-term cycling, this compound offers a more complex, metastable structural landscape that differentiates it from the simpler, more thermodynamically robust members of the group.
Related Compounds
Other Layered Lithium Transition-Metal Oxides in the database.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- mpaloe — Data from mpaloe.
- omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
Analyze Li5Nb2Ni3O10 in the Lattice Graph platform
Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.
Explore the Platform →