ZnMoO2

ZnMoO2 is a metastable semiconducting spinel oxide used in catalytic research.

Overview

About ZnMoO2

ZnMoO2 is a semiconducting oxide that belongs to the broader family of spinel-structured materials. As a metastable phase, it represents a unique structural arrangement of zinc, molybdenum, and oxygen atoms that offers distinct electronic properties for specialized chemical environments.

Its significance lies in its potential as a catalytic material, where its electronic character can be leveraged to facilitate specific surface reactions. While it exists in a metastable state, its structural diversity across reported configurations highlights its interest for researchers investigating non-equilibrium oxide catalysts.

At a glance

Key Properties

Cross-validated computational properties for ZnMoO2, aggregated across 3 databases.

Band Gap

0.23–1.46 eV
Range across DFT structures

Energy Above Hull

0.032 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

21
3 databases, 13 space groups
Uses

Applications

Where ZnMoO2 is used.

Catalysis researchSemiconductor materials science
Reference

Frequently Asked Questions

Common questions about ZnMoO2, answered from cross-validated data.

What is ZnMoO2?

ZnMoO2 is a metastable semiconducting spinel oxide used in catalytic research.

More questions
What is ZnMoO2 used for?
ZnMoO2 is used in catalysis research and semiconductor materials science.
What is the band gap of ZnMoO2?
ZnMoO2 has a DFT-computed band gap of 0.23–1.46 eV across 21 reported structures.
Is ZnMoO2 a metal, semiconductor, or insulator?
With a band gap up to 1.46 eV it is a semiconductor.
Is ZnMoO2 thermodynamically stable?
ZnMoO2 has a lowest energy above hull of 0.032 eV/atom (metastable).
How many polymorphs of ZnMoO2 are known?
21 structures of ZnMoO2 are reported across 3 databases, spanning 13 distinct space groups.
What elements does ZnMoO2 contain?
ZnMoO2 contains Mo, O, and Zn (3 elements).
Where does the data for ZnMoO2 come from?
ZnMoO2 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the spinel oxide catalysts class.

Unlike the highly stable and widely utilized binary oxides such as ZnO or NiO, ZnMoO2 occupies a more complex structural niche within the spinel oxide class. While simple oxides like ZnO serve as foundational semiconductors, ZnMoO2 provides a more intricate metal-cation framework that differentiates it from simpler structures like Al2O3 or complex perovskites like LaAlO3, positioning it as a specialized candidate for catalytic research.

Explore

Related Compounds

Other Spinel Oxide Catalysts in the database.

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

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