Cr8O21

Cr8O21 is a metastable, semiconducting chromium oxide used in specialized catalytic research.

Crystal structure of Cr8O21
Ground-state structure · Materials Project
Overview

About Cr8O21

Cr8O21 is a semiconducting oxide that belongs to the broader family of spinel-related catalytic materials. Its electronic structure is characterized by semiconducting behavior, which influences its interaction with chemical species during surface reactions. Although it exists in a metastable state, this compound represents a specialized niche in oxide chemistry where structural flexibility can be leveraged for specific catalytic pathways.

This material is primarily investigated for its potential in oxidation-reduction processes where transition metal oxides are essential. Its existence as a metastable phase suggests that its synthesis and application are highly sensitive to processing conditions, making it a subject of interest for researchers seeking to tune catalytic activity through structural control.

At a glance

Key Properties

Cross-validated computational properties for Cr8O21, aggregated across 3 databases.

Band Gap

0.85–1.70 eV
Range across DFT structures

Energy Above Hull

0.033 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

7
3 databases, 1 space group
Uses

Applications

Where Cr8O21 is used.

Catalytic oxidation processesRedox-active surface chemistry researchAdvanced materials synthesis
Reference

Frequently Asked Questions

Common questions about Cr8O21, answered from cross-validated data.

What is Cr8O21?

Cr8O21 is a metastable, semiconducting chromium oxide used in specialized catalytic research.

More questions
What is Cr8O21 used for?
Cr8O21 is used in catalytic oxidation processes, redox-active surface chemistry research, and advanced materials synthesis.
What is the band gap of Cr8O21?
Cr8O21 has a DFT-computed band gap of 0.85–1.70 eV across 7 reported structures.
Is Cr8O21 a metal, semiconductor, or insulator?
With a band gap up to 1.70 eV it is a semiconductor.
Is Cr8O21 thermodynamically stable?
Cr8O21 has a lowest energy above hull of 0.033 eV/atom (metastable).
How many polymorphs of Cr8O21 are known?
7 structures of Cr8O21 are reported across 3 databases, spanning 1 distinct space group.
What elements does Cr8O21 contain?
Cr8O21 contains Cr and O (2 elements).
Where does the data for Cr8O21 come from?
Cr8O21 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the spinel oxide catalysts class.

Unlike the highly stable and widely utilized MgAl2O4 or the common binary oxides like NiO and ZnO, Cr8O21 occupies a more complex and metastable position within the spinel oxide class. While compounds like LaMnO3 or LaNiO3 are frequently studied for their robust perovskite-based catalytic performance, Cr8O21 offers a distinct alternative for systems requiring specific chromium-based redox centers that are not present in more conventional, thermodynamically stable spinel structures.

Explore

Related Compounds

Other Spinel Oxide Catalysts in the database.

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

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