Sb3O4F

Sb3O4F is a semiconducting oxyfluoride compound that is theoretically stable and likely synthesizable for research purposes.

FOSb
Crystal structure of Sb3O4F
Ground-state structure · Materials Project
Overview

About Sb3O4F

Sb3O4F is an inorganic oxyfluoride characterized by its semiconducting electronic nature. Its composition, involving antimony, oxygen, and fluorine, suggests a complex structural arrangement that is of significant interest for fundamental materials science studies.

As a near-hull compound, it is considered likely to be synthesizable under appropriate experimental conditions. The existence of multiple reported structures across databases underscores its status as a material with diverse structural possibilities, making it a compelling subject for researchers investigating novel semiconducting phases.

At a glance

Key Properties

Cross-validated computational properties for Sb3O4F, aggregated across 3 databases.

Band Gap

2.43–2.78 eV
Range across DFT structures

Energy Above Hull

0.022 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

11
3 databases, 3 space groups
Uses

Applications

Where Sb3O4F is used.

Materials science researchSemiconductor developmentSolid-state chemistry investigations
Reference

Frequently Asked Questions

Common questions about Sb3O4F, answered from cross-validated data.

What is Sb3O4F?

Sb3O4F is a semiconducting oxyfluoride compound that is theoretically stable and likely synthesizable for research purposes.

More questions
What is Sb3O4F used for?
Sb3O4F is used in materials science research, semiconductor development, and solid-state chemistry investigations.
What is the band gap of Sb3O4F?
Sb3O4F has a DFT-computed band gap of 2.43–2.78 eV across 11 reported structures.
Is Sb3O4F a metal, semiconductor, or insulator?
With a band gap up to 2.78 eV it is a semiconductor.
Is Sb3O4F thermodynamically stable?
Sb3O4F has a lowest energy above hull of 0.022 eV/atom (near hull (likely stable)).
How many polymorphs of Sb3O4F are known?
11 structures of Sb3O4F are reported across 3 databases, spanning 3 distinct space groups.
What elements does Sb3O4F contain?
Sb3O4F contains F, O, and Sb (3 elements).
Where does the data for Sb3O4F come from?
Sb3O4F data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct oxyfluoride, Sb3O4F occupies a specialized niche in materials science. While it currently stands as a unique entry without direct structural siblings in this specific dataset, its ability to maintain stability while incorporating both oxygen and fluorine anions highlights its importance in the broader study of mixed-anion semiconductors.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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