LiCr2CoO6

LiCr2CoO6 is a metastable, semiconducting layered lithium transition-metal oxide used in advanced materials research for electrochemical applications.

Crystal structure of LiCr2CoO6
Ground-state structure · Materials Project
Overview

About LiCr2CoO6

LiCr2CoO6 is a complex layered lithium transition-metal oxide characterized by its semiconducting electronic nature. As a metastable phase, it represents a unique structural arrangement within the broader family of lithium-based oxides, offering researchers insight into the stability and electrochemical potential of multi-metal oxide systems.

This compound is primarily studied within the context of materials science for battery applications, where its specific transition-metal composition influences ion mobility and structural integrity. Its existence as a metastable material makes it a subject of interest for synthesis optimization and performance modeling in next-generation electrochemical devices.

At a glance

Key Properties

Cross-validated computational properties for LiCr2CoO6, aggregated across 3 databases.

Band Gap

0.50 eV
Range across DFT structures

Energy Above Hull

0.093 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where LiCr2CoO6 is used.

Battery materials researchSolid-state ionicsElectrochemical energy storage studies
Reference

Frequently Asked Questions

Common questions about LiCr2CoO6, answered from cross-validated data.

What is LiCr2CoO6?

LiCr2CoO6 is a metastable, semiconducting layered lithium transition-metal oxide used in advanced materials research for electrochemical applications.

More questions
What is LiCr2CoO6 used for?
LiCr2CoO6 is used in battery materials research, solid-state ionics, and electrochemical energy storage studies.
What is the band gap of LiCr2CoO6?
LiCr2CoO6 has a DFT-computed band gap of 0.50 eV across 5 reported structures.
Is LiCr2CoO6 a metal, semiconductor, or insulator?
With a band gap up to 0.50 eV it is a semiconductor.
Is LiCr2CoO6 thermodynamically stable?
LiCr2CoO6 has a lowest energy above hull of 0.093 eV/atom (metastable).
How many polymorphs of LiCr2CoO6 are known?
5 structures of LiCr2CoO6 are reported across 3 databases, spanning 1 distinct space group.
What elements does LiCr2CoO6 contain?
LiCr2CoO6 contains Co, Cr, Li, and O (4 elements).
Where does the data for LiCr2CoO6 come from?
LiCr2CoO6 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the layered lithium transition-metal oxides class.

Unlike the highly stable and commercially ubiquitous LiCoO2, LiCr2CoO6 exists in a metastable state, which presents distinct challenges and opportunities for structural engineering. While materials like LiNiO2 are widely utilized for their high capacity, this compound serves as a specialized research candidate for exploring how different transition-metal combinations can tune electronic behavior in layered oxide lattices.

Explore

Related Compounds

Other Layered Lithium Transition-Metal Oxides in the database.

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

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