Al6O24V6

Al6O24V6 is a stable, insulating spinel oxide catalyst composed of aluminum, vanadium, and oxygen.

Crystal structure of Al6O24V6 (triclinic, P-1 (No. 2))
Ground-state structure · Materials Project
Overview

About Al6O24V6

Al6O24V6 is a thermodynamically stable oxide that occupies a distinct position within the spinel oxide catalyst family. As a wide-band-gap insulator, it exhibits electronic properties that make it a compelling subject for fundamental materials research and potential catalytic applications.

Its structural integrity, confirmed by its presence on the convex hull, suggests high potential for durability in specialized chemical environments. Researchers study this compound to better understand the interplay between aluminum-vanadium-oxygen frameworks and their influence on surface reactivity.

At a glance

Key Properties

Cross-validated computational properties for Al6O24V6, aggregated across 3 databases.

Band Gap

3.04 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
Crystallography

Reported Structures

Lowest-energy structures reported for Al6O24V6, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-1 (No. 2)triclinic3.040.0000-8.2343.32
P-1 (No. 2)
P-1 (No. 2)
P-1 (No. 2)
P-1 (No. 2)
2.97
Uses

Applications

Where Al6O24V6 is used.

Catalysis researchMaterials science studies
Reference

Frequently Asked Questions

Common questions about Al6O24V6, answered from cross-validated data.

What is Al6O24V6?

Al6O24V6 is a stable, insulating spinel oxide catalyst composed of aluminum, vanadium, and oxygen.

More questions
What is Al6O24V6 used for?
Al6O24V6 is used in catalysis research and materials science studies.
What is the band gap of Al6O24V6?
Al6O24V6 has a DFT-computed band gap of 3.04 eV across 6 reported structures.
Is Al6O24V6 a metal, semiconductor, or insulator?
With a wide band gap up to 3.04 eV it is an insulator / wide-band-gap material.
Is Al6O24V6 thermodynamically stable?
Yes — Al6O24V6 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Al6O24V6?
The lowest-energy reported polymorph of Al6O24V6 is triclinic symmetry, space group P-1 (No. 2).
What is the density of Al6O24V6?
The computed density of the ground-state structure of Al6O24V6 is 3.32 g/cm³.
How many polymorphs of Al6O24V6 are known?
6 structures of Al6O24V6 are reported across 3 databases, spanning 1 distinct space group.
What elements does Al6O24V6 contain?
Al6O24V6 contains Al, O, and V (3 elements).
Where does the data for Al6O24V6 come from?
Al6O24V6 data is cross-referenced from materials_project, aflow, omat24.
Comparison

How It Compares

Within the spinel oxide catalysts class.

Unlike the highly conductive metallic perovskites like LaNiO3 or the simple binary oxides such as NiO and ZnO, Al6O24V6 functions as a robust insulating framework. While MgAl2O4 serves as a classic structural spinel, Al6O24V6 offers a unique electronic profile that differentiates it from the more common transition metal oxides in this class.

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Related Compounds

Other Spinel Oxide Catalysts in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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