AlBO3

aluminum borate · aluminum orthoborate

AlBO3 is a metastable, insulating aluminum borate compound categorized within the spinel oxide class of materials.

Crystal structure of AlBO3 (trigonal, R-3c (No. 167))
Ground-state structure · Materials Project
Overview

About aluminum borate

AlBO3 is a metastable inorganic compound belonging to the broader family of spinel oxide catalysts. Characterized by its wide-band-gap insulating electronic structure, it represents a unique architectural variation within the oxide landscape, offering distinct structural pathways compared to more common transition metal oxides.

Its role as a catalyst is defined by its specific atomic arrangement and thermodynamic profile. While it remains a subject of ongoing research, its potential utility lies in high-temperature chemical processes where stable, insulating oxide frameworks are required to facilitate specific surface reactions.

At a glance

Key Properties

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

Band Gap

5.84 eV
Range across DFT structures

Energy Above Hull

0.030 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

3
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for AlBO3, 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)trigonal5.840.0305-8.1723.50
R-3c (No. 167)
Uses

Applications

Where aluminum borate is used.

Catalytic support materialsRefractory ceramicsHigh-temperature chemical processing
Reference

Frequently Asked Questions

Common questions about aluminum borate, answered from cross-validated data.

What is AlBO3?

AlBO3 is a metastable, insulating aluminum borate compound categorized within the spinel oxide class of materials.

More questions
What is AlBO3 used for?
aluminum borate (AlBO3) is used in catalytic support materials, refractory ceramics, and high-temperature chemical processing.
What is the band gap of AlBO3?
aluminum borate (AlBO3) has a DFT-computed band gap of 5.84 eV across 3 reported structures.
Is AlBO3 a metal, semiconductor, or insulator?
With a wide band gap up to 5.84 eV it is an insulator / wide-band-gap material.
Is AlBO3 thermodynamically stable?
aluminum borate (AlBO3) has a lowest energy above hull of 0.030 eV/atom (metastable).
What is the crystal structure of AlBO3?
The lowest-energy reported polymorph of aluminum borate (AlBO3) is trigonal symmetry, space group R-3c (No. 167).
What is the density of AlBO3?
The computed density of the ground-state structure of aluminum borate (AlBO3) is 3.50 g/cm³.
How many polymorphs of AlBO3 are known?
3 structures of AlBO3 are reported across 3 databases, spanning 1 distinct space group.
What elements does AlBO3 contain?
aluminum borate (AlBO3) contains Al, B, and O (3 elements).
Where does the data for AlBO3 come from?
AlBO3 data is cross-referenced from materials_project, jarvis, alexandria.
Comparison

How It Compares

Within the spinel oxide catalysts class.

In contrast to highly stable, widely utilized spinel structures like MgAl2O4 or simple binary oxides such as ZnO and NiO, AlBO3 exists in a metastable state. While compounds like LaMnO3 or LaNiO3 are frequently employed for their complex electronic and magnetic properties in catalysis, AlBO3 provides a distinct, insulating alternative that lacks the metallic or semi-metallic character found in many of its perovskite-structured siblings.

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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).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • alexandria — Data from alexandria.

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