BaV2O6

BaV2O6 is a stable semiconducting ternary oxide used in the study of advanced electronic materials.

BaOV
Crystal structure of BaV2O6
Ground-state structure · Materials Project
Overview

About BaV2O6

BaV2O6 is a semiconducting oxide composed of barium, 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 is of significant interest in materials science due to its electronic characteristics and the versatility of the vanadium-oxygen framework. It serves as a foundational material for investigating complex oxide systems and their potential integration into functional electronic devices.

At a glance

Key Properties

Cross-validated computational properties for BaV2O6, aggregated across 3 databases.

Band Gap

2.88 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting BaV2O6.

Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where BaV2O6 is used.

Electronic material researchSolid-state chemistry studiesCatalysis research
Reference

Frequently Asked Questions

Common questions about BaV2O6, answered from cross-validated data.

What is BaV2O6?

BaV2O6 is a stable semiconducting ternary oxide used in the study of advanced electronic materials.

More questions
What is BaV2O6 used for?
BaV2O6 is used in electronic material research, solid-state chemistry studies, and catalysis research.
What is the band gap of BaV2O6?
BaV2O6 has a DFT-computed band gap of 2.88 eV across 5 reported structures.
Is BaV2O6 a metal, semiconductor, or insulator?
With a band gap up to 2.88 eV it is a semiconductor.
Is BaV2O6 thermodynamically stable?
Yes — BaV2O6 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of BaV2O6 are known?
5 structures of BaV2O6 are reported across 3 databases, spanning 1 distinct space group.
How is BaV2O6 synthesized?
Literature-reported routes for BaV2O6 include solid state (2 procedures documented).
What elements does BaV2O6 contain?
BaV2O6 contains Ba, O, and V (3 elements).
Where does the data for BaV2O6 come from?
BaV2O6 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a stable semiconducting oxide, BaV2O6 occupies a distinct position within the broader landscape of vanadium-based ternary oxides. It is highly regarded for its structural reliability, serving as a benchmark for researchers studying the interplay between transition metal oxidation states and semiconducting behavior in complex lattice environments.

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

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