Sb6O13

Sb6O13 is a semiconducting antimony oxide that exists in a near-hull thermodynamic state, making it a target for synthesis and structural study.

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Crystal structure of Sb6O13 (monoclinic, P21/m (No. 11))
Ground-state structure · Materials Project
Overview

About Sb6O13

Sb6O13 is a semiconducting oxide composed of antimony and oxygen. It is characterized by its near-hull thermodynamic stability, suggesting that it is a viable candidate for synthesis and experimental investigation within the broader family of antimony-based oxides. The material exhibits a complex structural framework, with multiple reported configurations documented across materials databases. This structural diversity makes it a subject of interest for researchers exploring the relationship between stoichiometry and electronic properties in binary metal oxides. Its semiconducting nature positions it as a potential candidate for specialized electronic or optoelectronic applications where precise band gap tuning is required.

At a glance

Key Properties

Cross-validated computational properties for Sb6O13, aggregated across 3 databases.

Band Gap

1.54–1.81 eV
Range across DFT structures

Energy Above Hull

0.024 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

6
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Sb6O13, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P21/m (No. 11)monoclinic1.540.0240-6.4715.70
Imm2 (No. 44)orthorhombic1.810.0293-6.4655.71
Imm2 (No. 44)Orthorhombic5.52
Imm2 (No. 44)Orthorhombic5.99
Imm2 (No. 44)
Imm2 (No. 44)Orthorhombic5.71
Uses

Applications

Where Sb6O13 is used.

Semiconductor researchMaterials science investigationCatalysis studies
Reference

Frequently Asked Questions

Common questions about Sb6O13, answered from cross-validated data.

What is Sb6O13?

Sb6O13 is a semiconducting antimony oxide that exists in a near-hull thermodynamic state, making it a target for synthesis and structural study.

More questions
What is Sb6O13 used for?
Sb6O13 is used in semiconductor research, materials science investigation, and catalysis studies.
What is the band gap of Sb6O13?
Sb6O13 has a DFT-computed band gap of 1.54–1.81 eV across 6 reported structures.
Is Sb6O13 a metal, semiconductor, or insulator?
With a band gap up to 1.81 eV it is a semiconductor.
Is Sb6O13 thermodynamically stable?
Sb6O13 has a lowest energy above hull of 0.024 eV/atom (near hull (likely stable)).
What is the crystal structure of Sb6O13?
The lowest-energy reported polymorph of Sb6O13 is monoclinic symmetry, space group P21/m (No. 11).
What is the density of Sb6O13?
The computed density of the ground-state structure of Sb6O13 is 5.70 g/cm³.
How many polymorphs of Sb6O13 are known?
6 structures of Sb6O13 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Sb6O13 contain?
Sb6O13 contains O and Sb (2 elements).
Where does the data for Sb6O13 come from?
Sb6O13 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

As a member of the antimony-oxygen system, Sb6O13 occupies a distinct compositional niche. While many binary oxides in this class are well-known, this specific stoichiometry represents a more nuanced phase that bridges the gap between simpler oxides, offering unique structural arrangements that are not present in more common, highly stable antimony oxide phases.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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