Li4Cr3NiO8

Li4Cr3NiO8 is a semiconducting layered lithium transition-metal oxide being studied for its potential role in advanced electrochemical energy storage systems.

Crystal structure of Li4Cr3NiO8
Ground-state structure · Materials Project
Overview

About Li4Cr3NiO8

Li4Cr3NiO8 is a complex layered lithium transition-metal oxide that exhibits semiconducting electronic behavior. Its structural characteristics and favorable thermodynamic stability relative to the convex hull suggest it is a viable candidate for synthesis and experimental investigation.

As a member of the layered oxide family, this compound is of significant interest for researchers developing advanced materials for electrochemical energy storage. Its unique stoichiometry allows for the exploration of multi-metal cation interactions within the lattice, which is essential for optimizing ion transport and structural integrity in battery environments.

At a glance

Key Properties

Cross-validated computational properties for Li4Cr3NiO8, aggregated across 3 databases.

Band Gap

0.32–0.45 eV
Range across DFT structures

Energy Above Hull

0.017 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

50
3 databases, 4 space groups
Uses

Applications

Where Li4Cr3NiO8 is used.

Lithium-ion battery researchElectrochemical energy storage developmentSolid-state electrolyte studies
Reference

Frequently Asked Questions

Common questions about Li4Cr3NiO8, answered from cross-validated data.

What is Li4Cr3NiO8?

Li4Cr3NiO8 is a semiconducting layered lithium transition-metal oxide being studied for its potential role in advanced electrochemical energy storage systems.

More questions
What is Li4Cr3NiO8 used for?
Li4Cr3NiO8 is used in lithium-ion battery research, electrochemical energy storage development, and solid-state electrolyte studies.
What is the band gap of Li4Cr3NiO8?
Li4Cr3NiO8 has a DFT-computed band gap of 0.32–0.45 eV across 50 reported structures.
Is Li4Cr3NiO8 a metal, semiconductor, or insulator?
With a band gap up to 0.45 eV it is a semiconductor.
Is Li4Cr3NiO8 thermodynamically stable?
Li4Cr3NiO8 has a lowest energy above hull of 0.017 eV/atom (near hull (likely stable)).
How many polymorphs of Li4Cr3NiO8 are known?
50 structures of Li4Cr3NiO8 are reported across 3 databases, spanning 4 distinct space groups.
What elements does Li4Cr3NiO8 contain?
Li4Cr3NiO8 contains Cr, Li, Ni, and O (4 elements).
Where does the data for Li4Cr3NiO8 come from?
Li4Cr3NiO8 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the layered lithium transition-metal oxides class.

Within the diverse family of layered lithium transition-metal oxides, Li4Cr3NiO8 occupies a distinct niche compared to well-established commercial standards like LiCoO2 or LiNiO2. While those materials are primarily utilized for their high capacity and stability, Li4Cr3NiO8 offers a different compositional balance, providing a platform to study how the inclusion of chromium alongside nickel influences the electronic properties and structural robustness of the oxide framework.

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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