LiTiV3O10

This complex oxide is a lithium-containing vanadium-titanium compound often investigated for its electrochemical properties. It is primarily studied as a potential electrode material for advanced energy storage systems due to its structural characteristics.

Crystal structure of LiTiV3O10 (monoclinic, C2 (No. 5))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for LiTiV3O10, aggregated across 3 databases.

Band Gap

1.88 eV
Range across DFT structures

Energy Above Hull

0.070 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for LiTiV3O10, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2 (No. 5)monoclinic1.880.0699-8.3032.98
C2 (No. 5)
C2 (No. 5)Monoclinic3.24
C2 (No. 5)Monoclinic2.98
C2 (No. 5)Monoclinic3.05
Uses

Applications

Where LiTiV3O10 is used.

Lithium-ion battery researchElectrochemical energy storage development
Reference

Frequently Asked Questions

Common questions about LiTiV3O10, answered from cross-validated data.

What is LiTiV3O10?

This complex oxide is a lithium-containing vanadium-titanium compound often investigated for its electrochemical properties. It is primarily studied as a potential electrode material for advanced energy storage systems due to its structural characteristics.

More questions
What is LiTiV3O10 used for?
LiTiV3O10 is used in lithium-ion battery research and electrochemical energy storage development.
What is the band gap of LiTiV3O10?
LiTiV3O10 has a DFT-computed band gap of 1.88 eV across 5 reported structures.
Is LiTiV3O10 a metal, semiconductor, or insulator?
With a band gap up to 1.88 eV it is a semiconductor.
Is LiTiV3O10 thermodynamically stable?
LiTiV3O10 has a lowest energy above hull of 0.070 eV/atom (metastable).
What is the crystal structure of LiTiV3O10?
The lowest-energy reported polymorph of LiTiV3O10 is monoclinic symmetry, space group C2 (No. 5).
What is the density of LiTiV3O10?
The computed density of the ground-state structure of LiTiV3O10 is 2.98 g/cm³.
How many polymorphs of LiTiV3O10 are known?
5 structures of LiTiV3O10 are reported across 3 databases, spanning 1 distinct space group.
What elements does LiTiV3O10 contain?
LiTiV3O10 contains Li, O, Ti, and V (4 elements).
Where does the data for LiTiV3O10 come from?
LiTiV3O10 data is cross-referenced from materials_project, jarvis, mpaloe.
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Related Compounds

Other Titanate Anodes in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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