Fe7O8

Fe7O8 is a metastable semiconducting iron oxide utilized primarily as an experimental conversion anode material for electrochemical energy storage.

Crystal structure of Fe7O8
Ground-state structure · Materials Project
Overview

About Fe7O8

Fe7O8 is a semiconducting iron oxide that functions as a conversion anode material. Its metastable nature makes it an intriguing subject for research into advanced battery architectures where structural flexibility and redox activity are critical for performance.

This compound represents a complex phase within the iron-oxygen system, contributing to the broader study of transition metal oxides in electrochemical energy storage. Its electronic properties and structural diversity are essential for understanding how iron-based materials can store charge through conversion reactions.

At a glance

Key Properties

Cross-validated computational properties for Fe7O8, aggregated across 4 databases.

Band Gap

1.07 eV
Range across DFT structures

Energy Above Hull

0.063 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

8
4 databases, 3 space groups
Validation

Cross-Source DFT Agreement

How well independent DFT databases agree on the thermodynamics of Fe7O8. Tight agreement means computed properties can be trusted without re-running calculations.

Agreement Score

1.00 / 1.00
Trust tier: medium

Hull Spread

0.000 eV
EAH spread across sources

Sources Compared

2
jarvis, materials_project

Space Group Consensus

All match
Uses

Applications

Where Fe7O8 is used.

Lithium-ion battery anodesElectrochemical energy storage research
Reference

Frequently Asked Questions

Common questions about Fe7O8, answered from cross-validated data.

What is Fe7O8?

Fe7O8 is a metastable semiconducting iron oxide utilized primarily as an experimental conversion anode material for electrochemical energy storage.

More questions
What is Fe7O8 used for?
Fe7O8 is used in lithium-ion battery anodes and electrochemical energy storage research.
What is the band gap of Fe7O8?
Fe7O8 has a DFT-computed band gap of 1.07 eV across 8 reported structures.
Is Fe7O8 a metal, semiconductor, or insulator?
With a band gap up to 1.07 eV it is a semiconductor.
Is Fe7O8 thermodynamically stable?
Fe7O8 has a lowest energy above hull of 0.063 eV/atom (metastable).
How many polymorphs of Fe7O8 are known?
8 structures of Fe7O8 are reported across 4 databases, spanning 3 distinct space groups.
What elements does Fe7O8 contain?
Fe7O8 contains Fe and O (2 elements).
Where does the data for Fe7O8 come from?
Fe7O8 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the conversion oxide anodes class.

Within the family of conversion oxide anodes, Fe7O8 occupies a unique position compared to more common iron oxides like Fe2O3 and Fe3O4. While those siblings are frequently studied for their stable, well-defined phases, Fe7O8 offers a distinct structural profile that differentiates it from the more widely utilized MnO2 or Co3O4, highlighting the diversity of iron-based conversion mechanisms.

Explore

Related Compounds

Other Conversion Oxide Anodes in the database.

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

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