ZnNiO2

ZnNiO2 is a stable semiconducting oxide material primarily investigated for its potential as an oxygen-evolution catalyst in electrochemical applications.

Crystal structure of ZnNiO2
Ground-state structure · Materials Project
Overview

About ZnNiO2

ZnNiO2 is a thermodynamically stable oxide that functions as a semiconducting material. Its unique electronic structure makes it a candidate for catalytic processes, particularly in the context of oxygen-evolution reactions where efficient charge transfer is essential for performance.

As a member of the transition metal oxide family, this compound benefits from a robust structural framework. Its stability on the convex hull suggests a reliable material profile, making it a subject of interest for researchers looking to optimize catalytic activity in energy storage and conversion devices.

At a glance

Key Properties

Cross-validated computational properties for ZnNiO2, aggregated across 3 databases.

Band Gap

0.14–0.98 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

33
3 databases, 15 space groups
Uses

Applications

Where ZnNiO2 is used.

Oxygen-evolution catalysisElectrochemical energy conversionSemiconductor research
Reference

Frequently Asked Questions

Common questions about ZnNiO2, answered from cross-validated data.

What is ZnNiO2?

ZnNiO2 is a stable semiconducting oxide material primarily investigated for its potential as an oxygen-evolution catalyst in electrochemical applications.

More questions
What is ZnNiO2 used for?
ZnNiO2 is used in oxygen-evolution catalysis, electrochemical energy conversion, and semiconductor research.
What is the band gap of ZnNiO2?
ZnNiO2 has a DFT-computed band gap of 0.14–0.98 eV across 33 reported structures.
Is ZnNiO2 a metal, semiconductor, or insulator?
With a band gap up to 0.98 eV it is a semiconductor.
Is ZnNiO2 thermodynamically stable?
Yes — ZnNiO2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of ZnNiO2 are known?
33 structures of ZnNiO2 are reported across 3 databases, spanning 15 distinct space groups.
What elements does ZnNiO2 contain?
ZnNiO2 contains Ni, O, and Zn (3 elements).
Where does the data for ZnNiO2 come from?
ZnNiO2 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the broad class of oxygen-evolution catalysts, ZnNiO2 occupies a distinct niche compared to well-known materials like NiO or LiCoO2. While many of its siblings, such as LaNiO3 or LaMnO3, are widely utilized for their perovskite-based properties, ZnNiO2 offers a different structural arrangement that provides a unique alternative for tuning catalytic surface reactivity.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

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

Analyze ZnNiO2 in the Lattice Graph platform

Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.

Explore the Platform →