NbFeO4

NbFeO4 is a stable, semiconducting oxide material utilized in the study of oxygen-evolution catalysis.

Crystal structure of NbFeO4
Ground-state structure · Materials Project
Overview

About NbFeO4

NbFeO4 is a thermodynamically stable oxide that functions as a semiconductor. Its position on the convex hull indicates high structural integrity, making it a robust candidate for materials science investigations involving oxygen-evolution catalysis. The compound is characterized by a significant degree of structural diversity, as evidenced by numerous reported configurations across multiple databases. This complexity allows researchers to explore how different atomic arrangements influence its catalytic performance in electrochemical environments. By serving as a stable platform for redox reactions, this material contributes to the broader understanding of transition metal oxides in energy-related applications.

At a glance

Key Properties

Cross-validated computational properties for NbFeO4, aggregated across 3 databases.

Band Gap

0.76–2.17 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

35
3 databases, 8 space groups
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting NbFeO4.

Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where NbFeO4 is used.

Oxygen-evolution catalysisElectrochemical researchTransition metal oxide development
Reference

Frequently Asked Questions

Common questions about NbFeO4, answered from cross-validated data.

What is NbFeO4?

NbFeO4 is a stable, semiconducting oxide material utilized in the study of oxygen-evolution catalysis.

More questions
What is NbFeO4 used for?
NbFeO4 is used in oxygen-evolution catalysis, electrochemical research, and transition metal oxide development.
What is the band gap of NbFeO4?
NbFeO4 has a DFT-computed band gap of 0.76–2.17 eV across 35 reported structures.
Is NbFeO4 a metal, semiconductor, or insulator?
With a band gap up to 2.17 eV it is a semiconductor.
Is NbFeO4 thermodynamically stable?
Yes — NbFeO4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of NbFeO4 are known?
35 structures of NbFeO4 are reported across 3 databases, spanning 8 distinct space groups.
How is NbFeO4 synthesized?
Literature-reported routes for NbFeO4 include sol gel, solid state (10 procedures documented).
What elements does NbFeO4 contain?
NbFeO4 contains Fe, Nb, and O (3 elements).
Where does the data for NbFeO4 come from?
NbFeO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the class of oxygen-evolution catalysts, NbFeO4 occupies a unique niche compared to more traditional battery-cathode materials like LiCoO2 or LiMn2O4. While those lithium-based oxides are optimized for ion intercalation and charge storage, NbFeO4 is primarily studied for its potential in catalytic surface reactions. Unlike the perovskite-structured LaMnO3, which is frequently utilized for its high conductivity and catalytic activity, NbFeO4 offers a distinct structural framework that provides researchers with an alternative pathway for tuning electronic properties in oxygen-evolution systems.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

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

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