ZnFeO2

ZnFeO2 is a stable, semiconducting oxide material utilized primarily in the field of oxygen-evolution catalysis for energy applications.

Crystal structure of ZnFeO2
Ground-state structure · Materials Project
Overview

About ZnFeO2

ZnFeO2 is a semiconducting oxide that sits on the thermodynamic convex hull, indicating exceptional structural stability. As a member of the oxygen-evolution catalyst class, it provides a robust framework for investigating electrochemical water splitting and related energy conversion processes.

With numerous reported structures across major databases, this compound is a subject of significant interest for materials scientists. Its electronic character makes it a versatile candidate for exploring charge-transfer mechanisms in catalytic environments where stability and performance are critical.

At a glance

Key Properties

Cross-validated computational properties for ZnFeO2, aggregated across 3 databases.

Band Gap

0.23–1.67 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

41
3 databases, 16 space groups
Uses

Applications

Where ZnFeO2 is used.

Oxygen-evolution catalysisElectrochemical water splittingEnergy conversion research
Reference

Frequently Asked Questions

Common questions about ZnFeO2, answered from cross-validated data.

What is ZnFeO2?

ZnFeO2 is a stable, semiconducting oxide material utilized primarily in the field of oxygen-evolution catalysis for energy applications.

More questions
What is ZnFeO2 used for?
ZnFeO2 is used in oxygen-evolution catalysis, electrochemical water splitting, and energy conversion research.
What is the band gap of ZnFeO2?
ZnFeO2 has a DFT-computed band gap of 0.23–1.67 eV across 41 reported structures.
Is ZnFeO2 a metal, semiconductor, or insulator?
With a band gap up to 1.67 eV it is a semiconductor.
Is ZnFeO2 thermodynamically stable?
Yes — ZnFeO2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of ZnFeO2 are known?
41 structures of ZnFeO2 are reported across 3 databases, spanning 16 distinct space groups.
What elements does ZnFeO2 contain?
ZnFeO2 contains Fe, O, and Zn (3 elements).
Where does the data for ZnFeO2 come from?
ZnFeO2 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the diverse landscape of oxygen-evolution catalysts, ZnFeO2 distinguishes itself through its thermodynamic stability compared to more complex perovskite-based oxides like LaNiO3 or LaMnO3. While materials such as LiCoO2 and LiMn2O4 are widely utilized in battery technologies, ZnFeO2 offers a distinct structural profile that complements the binary and ternary oxides in this class, providing a stable alternative for catalytic research.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

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

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