SbO2

Antimony tetroxide · Antimony(III,V) oxide

Antimony tetroxide is a mixed-valence inorganic compound containing antimony in two different oxidation states. It is primarily utilized as a flame retardant synergist and as a precursor in the production of various antimony-based materials.

OSb
Crystal structure of SbO2 (monoclinic, C2/c (No. 15))
Ground-state structure · Materials Project
Overview

Key Properties

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

Band Gap

0.43–2.76 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

311
4 databases, 35 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for SbO2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/c (No. 15)monoclinic2.030.0000-6.5146.65
Pna21 (No. 33)orthorhombic1.890.0015-6.5126.56
Pnna (No. 52)orthorhombic1.910.0054-6.5096.49
Pmmn (No. 59)orthorhombic2.760.0922-6.4224.28
Pnna (No. 52)orthorhombic1.770.1068-6.4075.75
Imma (No. 74)orthorhombic0.840.1387-6.3755.78
Pnma (No. 62)orthorhombic0.920.1471-6.3675.20
P1 (No. 1)triclinic1.210.1623-6.3524.46
P-1 (No. 2)triclinic1.050.1627-6.3514.68
P1 (No. 1)triclinic1.870.1707-6.3434.57
Cm (No. 8)monoclinic0.760.1734-6.3415.29
P-1 (No. 2)triclinic1.810.2483-6.2664.88
Uses

Applications

Where Antimony tetroxide is used.

Flame retardantsCeramic pigmentsCatalystsGlass manufacturing
Reference

Frequently Asked Questions

Common questions about Antimony tetroxide, answered from cross-validated data.

What is SbO2?

Antimony tetroxide is a mixed-valence inorganic compound containing antimony in two different oxidation states. It is primarily utilized as a flame retardant synergist and as a precursor in the production of various antimony-based materials.

More questions
What is SbO2 used for?
Antimony tetroxide (SbO2) is used in flame retardants, ceramic pigments, catalysts, and glass manufacturing.
What is the band gap of SbO2?
Antimony tetroxide (SbO2) has a DFT-computed band gap of 0.43–2.76 eV across 311 reported structures.
Is SbO2 a metal, semiconductor, or insulator?
With a band gap up to 2.76 eV it is a semiconductor.
Is SbO2 thermodynamically stable?
Yes — Antimony tetroxide (SbO2) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of SbO2?
The lowest-energy reported polymorph of Antimony tetroxide (SbO2) is monoclinic symmetry, space group C2/c (No. 15).
What is the density of SbO2?
The computed density of the ground-state structure of Antimony tetroxide (SbO2) is 6.65 g/cm³.
How many polymorphs of SbO2 are known?
311 structures of SbO2 are reported across 4 databases, spanning 35 distinct space groups.
What elements does SbO2 contain?
Antimony tetroxide (SbO2) contains O and Sb (2 elements).
Where does the data for SbO2 come from?
SbO2 data is cross-referenced from materials_project, jarvis.
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).

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