NiCO

NiCO is a metastable, insulating nickel-based oxide investigated for its potential role in oxygen-evolution catalytic processes.

Overview

About NiCO

NiCO is an inorganic compound categorized within the class of oxide oxygen-evolution catalysts. As a wide-band-gap insulator, it exhibits distinct electronic properties that differentiate it from the metallic or semi-conducting oxides often utilized in electrochemical energy conversion.

Due to its position above the thermodynamic hull, this material is considered metastable, posing significant challenges for synthesis and long-term stability. Its study contributes to the broader understanding of nickel-based oxide systems and their potential roles in complex catalytic environments.

At a glance

Key Properties

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

Band Gap

0.37–4.11 eV
Range across DFT structures

Energy Above Hull

0.537 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

19
3 databases, 11 space groups
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting NiCO.

Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where NiCO is used.

Oxygen-evolution catalysis researchFundamental materials science studies
Reference

Frequently Asked Questions

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

What is NiCO?

NiCO is a metastable, insulating nickel-based oxide investigated for its potential role in oxygen-evolution catalytic processes.

More questions
What is NiCO used for?
NiCO is used in oxygen-evolution catalysis research and fundamental materials science studies.
What is the band gap of NiCO?
NiCO has a DFT-computed band gap of 0.37–4.11 eV across 19 reported structures.
Is NiCO a metal, semiconductor, or insulator?
With a wide band gap up to 4.11 eV it is an insulator / wide-band-gap material.
Is NiCO thermodynamically stable?
NiCO has a lowest energy above hull of 0.537 eV/atom (above hull).
How many polymorphs of NiCO are known?
19 structures of NiCO are reported across 3 databases, spanning 11 distinct space groups.
How is NiCO synthesized?
Literature-reported routes for NiCO include solid state (3 procedures documented).
What elements does NiCO contain?
NiCO contains C, Ni, and O (3 elements).
Where does the data for NiCO come from?
NiCO data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Unlike the highly stable and widely utilized NiO or the layered lithium-intercalation oxides like LiCoO2 and LiNiO2, NiCO represents a more exotic and less thermodynamically favored phase within the nickel-oxide family, requiring specialized conditions to maintain its structural integrity compared to the robust perovskite structures like LaNiO3 or LaMnO3.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

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

Analyze NiCO in the Lattice Graph platform

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

Explore the Platform →