Li7Fe5O12

Li7Fe5O12 is a semimetallic lithium-iron oxide being studied as a potential catalyst for oxygen-evolution reactions in electrochemical energy systems.

Crystal structure of Li7Fe5O12
Ground-state structure · Materials Project
Overview

About Li7Fe5O12

Li7Fe5O12 is a complex lithium-iron oxide that functions within the class of oxygen-evolution catalysts. Characterized by a semimetallic electronic structure, this material offers unique charge-transport properties that are essential for facilitating efficient electrochemical reactions at the electrode interface. Its thermodynamic profile suggests it is near the stability hull, indicating that it is a viable target for experimental synthesis and structural characterization. Given the multiple reported structures associated with this composition, it remains a subject of significant interest for materials scientists exploring new catalytic pathways. This compound is primarily investigated for its potential role in energy conversion technologies where efficient oxygen evolution is a critical bottleneck. By leveraging its specific electronic character, researchers aim to optimize catalytic activity for sustainable energy applications.

At a glance

Key Properties

Cross-validated computational properties for Li7Fe5O12, aggregated across 3 databases.

Band Gap

0.05 eV
Range across DFT structures

Energy Above Hull

0.016 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

9
3 databases, 1 space group
Uses

Applications

Where Li7Fe5O12 is used.

Oxygen-evolution catalysisElectrochemical energy storage researchCatalytic material development
Reference

Frequently Asked Questions

Common questions about Li7Fe5O12, answered from cross-validated data.

What is Li7Fe5O12?

Li7Fe5O12 is a semimetallic lithium-iron oxide being studied as a potential catalyst for oxygen-evolution reactions in electrochemical energy systems.

More questions
What is Li7Fe5O12 used for?
Li7Fe5O12 is used in oxygen-evolution catalysis, electrochemical energy storage research, and catalytic material development.
What is the band gap of Li7Fe5O12?
Li7Fe5O12 has a DFT-computed band gap of 0.05 eV across 9 reported structures.
Is Li7Fe5O12 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Li7Fe5O12 thermodynamically stable?
Li7Fe5O12 has a lowest energy above hull of 0.016 eV/atom (near hull (likely stable)).
How many polymorphs of Li7Fe5O12 are known?
9 structures of Li7Fe5O12 are reported across 3 databases, spanning 1 distinct space group.
What elements does Li7Fe5O12 contain?
Li7Fe5O12 contains Fe, Li, and O (3 elements).
Where does the data for Li7Fe5O12 come from?
Li7Fe5O12 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the diverse family of oxide oxygen-evolution catalysts, Li7Fe5O12 occupies a distinct niche compared to more conventional layered oxides like LiCoO2 or LiNiO2. While many of its class members, such as LaMnO3 or BiFeO3, are well-established perovskite-based catalysts, Li7Fe5O12 offers a different structural complexity and electronic signature. Its semimetallic nature provides a different approach to conductivity compared to the insulating or semiconducting behavior often found in traditional transition metal oxides, positioning it as a unique alternative for specialized electrochemical 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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