Tl3VO4

Tl3VO4 is a stable, semiconducting thallium vanadate compound used in fundamental solid-state materials research.

OTlV
Crystal structure of Tl3VO4
Ground-state structure · Materials Project
Overview

About Tl3VO4

Tl3VO4 is a distinct ternary oxide composed of thallium, vanadium, and oxygen. As a thermodynamically stable phase located on the convex hull, it represents a robust crystalline arrangement that maintains structural integrity under standard conditions.

This compound exhibits semiconducting electronic characteristics, making it an interesting candidate for studies involving electronic transport and solid-state chemistry. Its existence across multiple reported structures highlights its significance within the broader landscape of complex metal vanadates.

At a glance

Key Properties

Cross-validated computational properties for Tl3VO4, aggregated across 3 databases.

Band Gap

2.60 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, 1 space group
Uses

Applications

Where Tl3VO4 is used.

Solid-state chemistry researchElectronic materials development
Reference

Frequently Asked Questions

Common questions about Tl3VO4, answered from cross-validated data.

What is Tl3VO4?

Tl3VO4 is a stable, semiconducting thallium vanadate compound used in fundamental solid-state materials research.

More questions
What is Tl3VO4 used for?
Tl3VO4 is used in solid-state chemistry research and electronic materials development.
What is the band gap of Tl3VO4?
Tl3VO4 has a DFT-computed band gap of 2.60 eV across 6 reported structures.
Is Tl3VO4 a metal, semiconductor, or insulator?
With a band gap up to 2.60 eV it is a semiconductor.
Is Tl3VO4 thermodynamically stable?
Yes — Tl3VO4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Tl3VO4 are known?
6 structures of Tl3VO4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Tl3VO4 contain?
Tl3VO4 contains O, Tl, and V (3 elements).
Where does the data for Tl3VO4 come from?
Tl3VO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique member of the vanadate family, Tl3VO4 serves as a foundational example of how heavy metal cations like thallium influence the electronic and structural properties of oxide frameworks. Without direct structural analogs in this specific set, it stands as a primary reference point for understanding the interplay between thallium-based sublattices and vanadium-oxygen coordination environments.

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

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