Li2TiNiO4

Li2TiNiO4 is a metastable, semiconducting layered oxide containing lithium, titanium, nickel, and oxygen, primarily studied for its potential in electrochemical energy storage applications.

Crystal structure of Li2TiNiO4
Ground-state structure · Materials Project
Overview

About Li2TiNiO4

Li2TiNiO4 belongs to the class of layered lithium transition-metal oxides, characterized by its semiconducting electronic nature. As a metastable compound, it represents a complex structural arrangement of lithium, titanium, nickel, and oxygen atoms that is of significant interest for fundamental materials science research.

This compound is primarily studied within the context of electrochemical energy storage. Its unique composition allows researchers to investigate ion transport and structural stability, providing insights into the design of next-generation battery electrode materials.

At a glance

Key Properties

Cross-validated computational properties for Li2TiNiO4, aggregated across 3 databases.

Band Gap

1.79 eV
Range across DFT structures

Energy Above Hull

0.035 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

11
3 databases, 2 space groups
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting Li2TiNiO4.

Sol Gel
Procedure available · ceder_sol_gel
Uses

Applications

Where Li2TiNiO4 is used.

battery electrode researchelectrochemical energy storage studies
Reference

Frequently Asked Questions

Common questions about Li2TiNiO4, answered from cross-validated data.

What is Li2TiNiO4?

Li2TiNiO4 is a metastable, semiconducting layered oxide containing lithium, titanium, nickel, and oxygen, primarily studied for its potential in electrochemical energy storage applications.

More questions
What is Li2TiNiO4 used for?
Li2TiNiO4 is used in battery electrode research and electrochemical energy storage studies.
What is the band gap of Li2TiNiO4?
Li2TiNiO4 has a DFT-computed band gap of 1.79 eV across 11 reported structures.
Is Li2TiNiO4 a metal, semiconductor, or insulator?
With a band gap up to 1.79 eV it is a semiconductor.
Is Li2TiNiO4 thermodynamically stable?
Li2TiNiO4 has a lowest energy above hull of 0.035 eV/atom (metastable).
How many polymorphs of Li2TiNiO4 are known?
11 structures of Li2TiNiO4 are reported across 3 databases, spanning 2 distinct space groups.
How is Li2TiNiO4 synthesized?
Literature-reported routes for Li2TiNiO4 include sol gel.
What elements does Li2TiNiO4 contain?
Li2TiNiO4 contains Li, Ni, O, and Ti (4 elements).
Where does the data for Li2TiNiO4 come from?
Li2TiNiO4 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, Li2TiNiO4 occupies a distinct position compared to more conventional, highly stable cathode materials like LiCoO2 or LiNiO2. While those siblings are widely utilized for their robust cycling performance, Li2TiNiO4 represents a more complex, metastable phase that challenges existing models of structural evolution in lithium-rich oxide systems.

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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