MgAl2O4

Spinel · Magnesium aluminate, Magnesium aluminum oxide

Spinel is a naturally occurring mineral that serves as the namesake for a broader group of oxide minerals sharing the same crystal structure. Due to its exceptional hardness and resistance to heat, it is widely utilized in industrial settings as a refractory material and as a durable optical component.

Crystal structure of MgAl2O4 (cubic, Fd-3m (No. 227))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Spinel, aggregated across 4 databases.

Band Gap

2.71–5.11 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

41
4 databases, 12 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for MgAl2O4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Fd-3m (No. 227)cubic5.110.0000-7.5003.58
R3m (No. 160)trigonal4.570.0074-7.4933.59
C2/m (No. 12)monoclinic4.460.0077-7.4933.47
Cm (No. 8)monoclinic3.810.0091-7.4913.59
P3m1 (No. 156)trigonal4.590.0100-7.4913.47
P3m1 (No. 156)trigonal4.120.0132-7.4873.59
R3m (No. 160)trigonal4.200.0165-7.4843.47
R3m (No. 160)trigonal4.280.0206-7.4803.47
P3m1 (No. 156)trigonal4.250.0270-7.4733.47
Cm (No. 8)monoclinic4.380.0271-7.4733.47
Cm (No. 8)monoclinic2.850.0315-7.4693.47
R3m (No. 160)trigonal4.030.0332-7.4673.48
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting MgAl2O4.

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 Spinel is used.

Refractory linings for furnacesOptical windows and lensesGemstonesCatalyst supportsCeramic components
Reference

Frequently Asked Questions

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

What is MgAl2O4?

Spinel is a naturally occurring mineral that serves as the namesake for a broader group of oxide minerals sharing the same crystal structure. Due to its exceptional hardness and resistance to heat, it is widely utilized in industrial settings as a refractory material and as a durable optical component.

More questions
What is MgAl2O4 used for?
Spinel (MgAl2O4) is used in refractory linings for furnaces, optical windows and lenses, gemstones, catalyst supports, and ceramic components.
What is the band gap of MgAl2O4?
Spinel (MgAl2O4) has a DFT-computed band gap of 2.71–5.11 eV across 41 reported structures.
Is MgAl2O4 a metal, semiconductor, or insulator?
With a wide band gap up to 5.11 eV it is an insulator / wide-band-gap material.
Is MgAl2O4 thermodynamically stable?
Yes — Spinel (MgAl2O4) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of MgAl2O4?
The lowest-energy reported polymorph of Spinel (MgAl2O4) is cubic symmetry, space group Fd-3m (No. 227).
What is the density of MgAl2O4?
The computed density of the ground-state structure of Spinel (MgAl2O4) is 3.58 g/cm³.
How many polymorphs of MgAl2O4 are known?
41 structures of MgAl2O4 are reported across 4 databases, spanning 12 distinct space groups.
How is MgAl2O4 synthesized?
Literature-reported routes for MgAl2O4 include sol-gel (10 procedures documented).
What elements does MgAl2O4 contain?
Spinel (MgAl2O4) contains Al, Mg, and O (3 elements).
Where does the data for MgAl2O4 come from?
MgAl2O4 data is cross-referenced from materials_project, mpaloe.
Explore

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).
  • mpaloe — Data from mpaloe.

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