B2Fe6O10

B2Fe6O10 is a stable, semiconducting iron-boron oxide designed for use in oxygen-evolution catalytic applications.

Crystal structure of B2Fe6O10
Ground-state structure · Materials Project
Overview

About B2Fe6O10

B2Fe6O10 is a semiconducting iron-based oxide that occupies a stable position on the thermodynamic convex hull. Its unique structural arrangement, supported by multiple reported configurations, makes it a subject of interest for electrochemical processes involving oxygen evolution.

As an oxide oxygen-evolution catalyst, this compound leverages its electronic properties to facilitate complex surface reactions. Its stability suggests potential for long-term performance in catalytic environments where structural integrity under operational stress is paramount.

At a glance

Key Properties

Cross-validated computational properties for B2Fe6O10, aggregated across 3 databases.

Band Gap

0.02–1.02 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

10
3 databases, 3 space groups
Uses

Applications

Where B2Fe6O10 is used.

Oxygen-evolution catalysisElectrochemical energy conversion
Reference

Frequently Asked Questions

Common questions about B2Fe6O10, answered from cross-validated data.

What is B2Fe6O10?

B2Fe6O10 is a stable, semiconducting iron-boron oxide designed for use in oxygen-evolution catalytic applications.

More questions
What is B2Fe6O10 used for?
B2Fe6O10 is used in oxygen-evolution catalysis and electrochemical energy conversion.
What is the band gap of B2Fe6O10?
B2Fe6O10 has a DFT-computed band gap of 0.02–1.02 eV across 10 reported structures.
Is B2Fe6O10 a metal, semiconductor, or insulator?
With a band gap up to 1.02 eV it is a semiconductor.
Is B2Fe6O10 thermodynamically stable?
Yes — B2Fe6O10 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of B2Fe6O10 are known?
10 structures of B2Fe6O10 are reported across 3 databases, spanning 3 distinct space groups.
What elements does B2Fe6O10 contain?
B2Fe6O10 contains B, Fe, and O (3 elements).
Where does the data for B2Fe6O10 come from?
B2Fe6O10 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the broad class of oxide oxygen-evolution catalysts, B2Fe6O10 serves as a specialized iron-rich alternative to the more common transition metal oxides like NiO or perovskite-structured materials such as LaMnO3 and BiFeO3. While many class members rely on nickel or cobalt centers, this compound utilizes a distinct boron-iron framework that differentiates its catalytic mechanism and electronic landscape from the standard lithium-based intercalation oxides like LiCoO2.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

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

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