CoO3Ti
CoO3Ti is a semiconducting ternary oxide being researched for its potential role in oxygen-evolution catalysis and electrochemical energy systems.
About CoO3Ti
CoO3Ti is a complex oxide belonging to the class of oxygen-evolution catalysts. As a semiconducting material, it is positioned as a candidate for electrochemical applications where efficient charge transfer and surface reactivity are critical for water splitting and energy conversion processes.
Its status as a near-hull stable compound suggests it is a viable target for experimental synthesis and structural characterization. With multiple reported structures across databases, it represents a significant subject of study for researchers aiming to optimize catalytic performance through precise atomic arrangement.
Key Properties
Cross-validated computational properties for CoO3Ti, aggregated across 4 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.
Cross-Source DFT Agreement
How well independent DFT databases agree on the thermodynamics of CoO3Ti. Tight agreement means computed properties can be trusted without re-running calculations.
Agreement ScoreA normalized confidence score summarizing how closely independent DFT databases agree. Higher scores mean tighter cross-source agreement.
Hull SpreadDifference between the highest and lowest energy-above-hull values reported by comparable sources. Smaller spread means less thermodynamic disagreement.
Sources ComparedNumber and names of computational sources with comparable entries for this formula.
Space Group ConsensusWhether independent sources predict the same crystal symmetry for the lowest-energy structure.
Applications
Where CoO3Ti is used.
Frequently Asked Questions
Common questions about CoO3Ti, answered from cross-validated data.
What is CoO3Ti?
CoO3Ti is a semiconducting ternary oxide being researched for its potential role in oxygen-evolution catalysis and electrochemical energy systems.
What is CoO3Ti used for?
What is the band gap of CoO3Ti?
Is CoO3Ti a metal, semiconductor, or insulator?
Is CoO3Ti thermodynamically stable?
How many polymorphs of CoO3Ti are known?
What elements does CoO3Ti contain?
Where does the data for CoO3Ti come from?
How It Compares
Within the oxide oxygen-evolution catalysts class.
Within the diverse landscape of oxygen-evolution catalysts, CoO3Ti occupies a unique space compared to established perovskite-like structures such as LaNiO3 or LaMnO3. While many members of this class rely on well-understood transition metal frameworks, CoO3Ti provides a distinct electronic environment that differentiates it from simpler binary oxides like NiO or the widely utilized battery cathode materials like LiCoO2.
Related Compounds
Other Oxide Oxygen-Evolution Catalysts in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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