MgSbO3

MgSbO3 is a stable, semiconducting ternary oxide composed of magnesium, antimony, and oxygen.

MgOSb
Crystal structure of MgSbO3 (tetragonal, P42/mnm (No. 136))
Ground-state structure · Materials Project
Overview

About MgSbO3

MgSbO3 is a complex oxide composed of magnesium, antimony, and oxygen. As a thermodynamically stable compound residing on the convex hull, it represents a robust structural configuration that maintains integrity under standard conditions.

This material exhibits semiconducting electronic character, making it a subject of interest for researchers investigating oxide-based electronics. With multiple reported structural variations, it offers a versatile platform for studying how atomic arrangements influence electronic behavior in ternary oxide systems.

At a glance

Key Properties

Cross-validated computational properties for MgSbO3, aggregated across 3 databases.

Band Gap

0.57–2.00 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

9
3 databases, 4 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for MgSbO3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P42/mnm (No. 136)tetragonal1.040.0000-6.6215.76
Pmn21 (No. 31)orthorhombic1.530.1420-6.4795.41
P21/c (No. 14)monoclinic2.000.1586-6.3345.26
P21/m (No. 11)monoclinic0.570.1984-6.2945.25
P21/c (No. 14)
P21/m (No. 11)
P21/c (No. 14)Monoclinic5.26
P21/c (No. 14)Monoclinic5.65
P21/c (No. 14)Monoclinic5.46
Uses

Applications

Where MgSbO3 is used.

Semiconductor researchMaterials science explorationOxide electronics development
Reference

Frequently Asked Questions

Common questions about MgSbO3, answered from cross-validated data.

What is MgSbO3?

MgSbO3 is a stable, semiconducting ternary oxide composed of magnesium, antimony, and oxygen.

More questions
What is MgSbO3 used for?
MgSbO3 is used in semiconductor research, materials science exploration, and oxide electronics development.
What is the band gap of MgSbO3?
MgSbO3 has a DFT-computed band gap of 0.57–2.00 eV across 9 reported structures.
Is MgSbO3 a metal, semiconductor, or insulator?
With a band gap up to 2.00 eV it is a semiconductor.
Is MgSbO3 thermodynamically stable?
Yes — MgSbO3 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of MgSbO3?
The lowest-energy reported polymorph of MgSbO3 is tetragonal symmetry, space group P42/mnm (No. 136).
What is the density of MgSbO3?
The computed density of the ground-state structure of MgSbO3 is 5.76 g/cm³.
How many polymorphs of MgSbO3 are known?
9 structures of MgSbO3 are reported across 3 databases, spanning 4 distinct space groups.
What elements does MgSbO3 contain?
MgSbO3 contains Mg, O, and Sb (3 elements).
Where does the data for MgSbO3 come from?
MgSbO3 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a distinct ternary oxide, MgSbO3 serves as a foundational example of stable magnesium-antimony-oxygen chemistry. It provides a baseline for understanding the structural and electronic landscape of similar complex oxides, particularly those where the interplay between magnesium and antimony cations dictates the resulting semiconducting properties.

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).
  • mpaloe — Data from mpaloe.

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