LiTiCrO4

LiTiCrO4 is a stable semiconducting titanate material used in the study and development of advanced battery anode technologies.

Crystal structure of LiTiCrO4
Ground-state structure · Materials Project
Overview

About LiTiCrO4

LiTiCrO4 is a complex oxide belonging to the titanate anode class, characterized by its semiconducting electronic nature. Its position on the thermodynamic convex hull highlights its inherent stability, making it a robust candidate for energy storage research.

This material is primarily investigated for its role in electrochemical systems where stable titanate frameworks are required. Its unique combination of lithium, titanium, and chromium within an oxygen lattice provides a distinct structural profile for ion transport and intercalation applications.

At a glance

Key Properties

Cross-validated computational properties for LiTiCrO4, aggregated across 3 databases.

Band Gap

1.75–1.89 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

6
3 databases, 2 space groups
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting LiTiCrO4.

Sol Gel
Procedure available · ceder_sol_gel
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where LiTiCrO4 is used.

Lithium-ion battery anodesElectrochemical energy storage researchSolid-state ionics
Reference

Frequently Asked Questions

Common questions about LiTiCrO4, answered from cross-validated data.

What is LiTiCrO4?

LiTiCrO4 is a stable semiconducting titanate material used in the study and development of advanced battery anode technologies.

More questions
What is LiTiCrO4 used for?
LiTiCrO4 is used in lithium-ion battery anodes, electrochemical energy storage research, and solid-state ionics.
What is the band gap of LiTiCrO4?
LiTiCrO4 has a DFT-computed band gap of 1.75–1.89 eV across 6 reported structures.
Is LiTiCrO4 a metal, semiconductor, or insulator?
With a band gap up to 1.89 eV it is a semiconductor.
Is LiTiCrO4 thermodynamically stable?
Yes — LiTiCrO4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of LiTiCrO4 are known?
6 structures of LiTiCrO4 are reported across 3 databases, spanning 2 distinct space groups.
How is LiTiCrO4 synthesized?
Literature-reported routes for LiTiCrO4 include sol gel, solid state (3 procedures documented).
What elements does LiTiCrO4 contain?
LiTiCrO4 contains Cr, Li, O, and Ti (4 elements).
Where does the data for LiTiCrO4 come from?
LiTiCrO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the titanate anodes class.

Within the broader family of titanate anodes, LiTiCrO4 stands out due to its specific elemental composition compared to siblings like Li2TiCr3O8. While many titanates in this class are utilized for their structural versatility, LiTiCrO4 offers a unique electronic environment that distinguishes it from more common lithium-titanium oxides like Li2TiO3.

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Related Compounds

Other Titanate Anodes in the database.

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

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