Al2O3

Alumina · Aluminum oxide, Corundum

Alumina is a chemically stable, insulating aluminum oxide widely utilized as a structural component and a versatile support material for catalysts.

Crystal structure of Al2O3 (trigonal, R-3c (No. 167))
Ground-state structure · Materials Project
Overview

About Alumina

Alumina is a thermodynamically stable oxide that serves as a cornerstone material in materials science. Its wide-band-gap electronic character makes it an exceptional electrical insulator, while its structural robustness ensures longevity in demanding chemical environments.

Because of its chemical inertness and high surface area potential, it is widely utilized as a catalyst support. It provides a stable framework for active metal phases, facilitating efficient chemical transformations across various industrial processes.

At a glance

Key Properties

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

Band Gap

0.05–5.85 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

277
3 databases, 39 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Al2O3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R-3c (No. 167)trigonal5.850.0000-7.8943.87
C2/m (No. 12)monoclinic4.460.0172-7.8763.63
Pna21 (No. 33)orthorhombic4.830.0208-7.8733.78
Ia-3 (No. 206)cubic5.510.0350-7.8593.87
P2/c (No. 13)monoclinic4.310.0351-7.8583.57
C2/c (No. 15)monoclinic4.140.0395-7.8543.70
Pbca (No. 61)orthorhombic5.820.0463-7.8474.04
C2/m (No. 12)monoclinic3.780.0491-7.8443.69
Cm (No. 8)monoclinic3.200.0571-7.8363.56
R-3 (No. 148)trigonal5.670.0747-7.8193.81
P-31c (No. 163)trigonal5.490.0819-7.8123.80
C2/m (No. 12)monoclinic4.210.0849-7.8093.09
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting Al2O3.

Sol-Gel
Procedure available · ceder_solid_state
Sol-Gel
Procedure available · ceder_solid_state
Sol-Gel
Procedure available · ceder_solid_state
Sol-Gel
Procedure available · ceder_solid_state
Sol-Gel
Procedure available · ceder_solid_state
Sol-Gel
Procedure available · ceder_solid_state
Uses

Applications

Where Alumina is used.

Catalyst supportAbrasive materialsElectrical insulatorsRefractory ceramicsThin-film dielectric layers
Reference

Frequently Asked Questions

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

What is Al2O3?

Alumina is a chemically stable, insulating aluminum oxide widely utilized as a structural component and a versatile support material for catalysts.

More questions
What is Al2O3 used for?
Alumina (Al2O3) is used in catalyst support, abrasive materials, electrical insulators, refractory ceramics, and thin-film dielectric layers.
What is the band gap of Al2O3?
Alumina (Al2O3) has a DFT-computed band gap of 0.05–5.85 eV across 277 reported structures.
Is Al2O3 a metal, semiconductor, or insulator?
With a wide band gap up to 5.85 eV it is an insulator / wide-band-gap material.
Is Al2O3 thermodynamically stable?
Yes — Alumina (Al2O3) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Al2O3?
The lowest-energy reported polymorph of Alumina (Al2O3) is trigonal symmetry, space group R-3c (No. 167).
What is the density of Al2O3?
The computed density of the ground-state structure of Alumina (Al2O3) is 3.87 g/cm³.
How many polymorphs of Al2O3 are known?
277 structures of Al2O3 are reported across 3 databases, spanning 39 distinct space groups.
How is Al2O3 synthesized?
Literature-reported routes for Al2O3 include sol-gel (10 procedures documented).
What elements does Al2O3 contain?
Alumina (Al2O3) contains Al and O (2 elements).
Where does the data for Al2O3 come from?
Al2O3 data is cross-referenced from materials_project.
Comparison

How It Compares

Within the spinel oxide catalysts class.

Within the family of spinel and complex oxides, Alumina stands out for its extreme thermodynamic stability and insulating nature compared to transition metal-based catalysts like CuO or NiO. While materials such as LaAlO3 share structural similarities in their oxide frameworks, Alumina is primarily valued for its role as an inert, high-performance substrate rather than for the redox-active properties found in perovskites like LaMnO3 or BiFeO3.

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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).

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