LiTiVO4

LiTiVO4 is a thermodynamically stable semiconducting titanate used in the study of advanced battery anode materials.

Crystal structure of LiTiVO4
Ground-state structure · Materials Project
Overview

About LiTiVO4

LiTiVO4 is a semiconducting titanate compound that exists in a thermodynamically stable state on the convex hull. Its electronic structure and structural integrity make it a subject of interest for researchers investigating next-generation electrode materials for electrochemical energy storage systems.

As a member of the titanate anode class, this material benefits from a robust crystalline framework. Its stability and semiconducting nature provide a foundation for exploring ion transport mechanisms and redox activity relevant to high-performance battery technologies.

At a glance

Key Properties

Cross-validated computational properties for LiTiVO4, aggregated across 3 databases.

Band Gap

0.42–1.50 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

12
3 databases, 2 space groups
Uses

Applications

Where LiTiVO4 is used.

Lithium-ion battery anodesElectrochemical energy storage research
Reference

Frequently Asked Questions

Common questions about LiTiVO4, answered from cross-validated data.

What is LiTiVO4?

LiTiVO4 is a thermodynamically stable semiconducting titanate used in the study of advanced battery anode materials.

More questions
What is LiTiVO4 used for?
LiTiVO4 is used in lithium-ion battery anodes and electrochemical energy storage research.
What is the band gap of LiTiVO4?
LiTiVO4 has a DFT-computed band gap of 0.42–1.50 eV across 12 reported structures.
Is LiTiVO4 a metal, semiconductor, or insulator?
With a band gap up to 1.50 eV it is a semiconductor.
Is LiTiVO4 thermodynamically stable?
Yes — LiTiVO4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of LiTiVO4 are known?
12 structures of LiTiVO4 are reported across 3 databases, spanning 2 distinct space groups.
What elements does LiTiVO4 contain?
LiTiVO4 contains Li, O, Ti, and V (4 elements).
Where does the data for LiTiVO4 come from?
LiTiVO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the titanate anodes class.

Within the diverse family of titanate anodes, LiTiVO4 occupies a distinct position compared to structural relatives like Li2TiVO4 and Li2TiO3. While many of its siblings are characterized by varying lithium-to-metal ratios that influence their electrochemical capacity and insertion kinetics, LiTiVO4 offers a unique stoichiometry that balances structural stability with the electronic requirements for efficient charge transfer.

Explore

Related Compounds

Other Titanate Anodes in the database.

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

Analyze LiTiVO4 in the Lattice Graph platform

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

Explore the Platform →