Fe4As2O11

Fe4As2O11 is a metastable semiconducting iron-arsenic oxide being researched for its potential as an oxygen-evolution catalyst.

Crystal structure of Fe4As2O11
Ground-state structure · Materials Project
Overview

About Fe4As2O11

Fe4As2O11 is a complex iron-arsenic oxide that functions as a semiconducting material. Within the broader landscape of oxide-based catalysts, it represents a specialized composition that has been characterized through multiple distinct structural configurations across various databases. Its role as a metastable phase makes it a subject of interest for researchers exploring unconventional pathways in chemical synthesis and materials design. By leveraging its unique electronic environment, this compound is evaluated for its potential to facilitate oxygen-evolution reactions, a critical process for efficient energy conversion technologies. Its structural complexity offers a distinct contrast to simpler binary oxides, providing a rich platform for studying catalytic surface interactions.

At a glance

Key Properties

Cross-validated computational properties for Fe4As2O11, aggregated across 3 databases.

Band Gap

0.73–0.99 eV
Range across DFT structures

Energy Above Hull

0.043 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

6
3 databases, 2 space groups
Uses

Applications

Where Fe4As2O11 is used.

Oxygen-evolution catalysisEnergy conversion research
Reference

Frequently Asked Questions

Common questions about Fe4As2O11, answered from cross-validated data.

What is Fe4As2O11?

Fe4As2O11 is a metastable semiconducting iron-arsenic oxide being researched for its potential as an oxygen-evolution catalyst.

More questions
What is Fe4As2O11 used for?
Fe4As2O11 is used in oxygen-evolution catalysis and energy conversion research.
What is the band gap of Fe4As2O11?
Fe4As2O11 has a DFT-computed band gap of 0.73–0.99 eV across 6 reported structures.
Is Fe4As2O11 a metal, semiconductor, or insulator?
With a band gap up to 0.99 eV it is a semiconductor.
Is Fe4As2O11 thermodynamically stable?
Fe4As2O11 has a lowest energy above hull of 0.043 eV/atom (metastable).
How many polymorphs of Fe4As2O11 are known?
6 structures of Fe4As2O11 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Fe4As2O11 contain?
Fe4As2O11 contains As, Fe, and O (3 elements).
Where does the data for Fe4As2O11 come from?
Fe4As2O11 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Unlike the highly stable and widely utilized transition metal oxides such as NiO or the layered lithium-based intercalation compounds like LiCoO2 and LiNiO2, Fe4As2O11 exists as a metastable phase. While perovskite-structured materials like LaMnO3 or BiFeO3 are frequently studied for their robust electronic properties in catalysis, this iron-arsenic oxide occupies a more niche position due to its specific elemental composition and structural constraints, offering a different catalytic profile compared to the more conventional lanthanum-based systems.

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Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

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

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