Co2OF3

Co2OF3 is a metastable, semiconducting oxyfluoride compound studied for its potential role as a catalyst in oxygen-evolution reactions.

Crystal structure of Co2OF3
Ground-state structure · Materials Project
Overview

About Co2OF3

Co2OF3 is a semiconducting oxyfluoride that functions within the class of oxide oxygen-evolution catalysts. Its unique composition of cobalt, oxygen, and fluorine positions it as an intriguing candidate for electrochemical studies where charge transport and surface reactivity are critical. As a metastable phase, this compound represents a specialized structural configuration that deviates from standard oxide catalysts. It is primarily investigated for its potential to facilitate complex redox reactions, offering a distinct electronic environment compared to conventional transition metal oxides.

At a glance

Key Properties

Cross-validated computational properties for Co2OF3, aggregated across 2 databases.

Band Gap

0.08–0.74 eV
Range across DFT structures

Energy Above Hull

0.052 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

30
2 databases, 8 space groups
Uses

Applications

Where Co2OF3 is used.

Oxygen-evolution catalysisElectrochemical researchAdvanced material synthesis
Reference

Frequently Asked Questions

Common questions about Co2OF3, answered from cross-validated data.

What is Co2OF3?

Co2OF3 is a metastable, semiconducting oxyfluoride compound studied for its potential role as a catalyst in oxygen-evolution reactions.

More questions
What is Co2OF3 used for?
Co2OF3 is used in oxygen-evolution catalysis, electrochemical research, and advanced material synthesis.
What is the band gap of Co2OF3?
Co2OF3 has a DFT-computed band gap of 0.08–0.74 eV across 30 reported structures.
Is Co2OF3 a metal, semiconductor, or insulator?
With a band gap up to 0.74 eV it is a semiconductor.
Is Co2OF3 thermodynamically stable?
Co2OF3 has a lowest energy above hull of 0.052 eV/atom (metastable).
How many polymorphs of Co2OF3 are known?
30 structures of Co2OF3 are reported across 2 databases, spanning 8 distinct space groups.
What elements does Co2OF3 contain?
Co2OF3 contains Co, F, and O (3 elements).
Where does the data for Co2OF3 come from?
Co2OF3 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the broader family of oxide oxygen-evolution catalysts, Co2OF3 stands out as a less conventional, metastable alternative to well-established materials like LiCoO2 or LaMnO3. While many of its siblings rely on standard oxide lattices to drive catalytic activity, the inclusion of fluorine in the Co2OF3 framework modifies its electronic landscape, providing a different pathway for oxygen evolution compared to the more traditional perovskite-based structures like LaNiO3.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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