WBr4O

WBr4O is a semiconducting tungsten oxybromide compound that exists as a metastable phase with complex structural characteristics.

BrOW
Crystal structure of WBr4O
Ground-state structure · Materials Project
Overview

About WBr4O

WBr4O is a complex inorganic compound composed of tungsten, bromine, and oxygen. As a semiconducting material, it exhibits electronic properties that distinguish it from simple binary halides or oxides, making it a subject of interest for fundamental materials research. The compound is characterized by a high degree of structural complexity, with multiple reported configurations across various databases. Its position above the thermodynamic hull suggests that it is a metastable phase, requiring specific synthesis conditions to stabilize its unique atomic arrangement.

At a glance

Key Properties

Cross-validated computational properties for WBr4O, aggregated across 3 databases.

Band Gap

1.12–1.46 eV
Range across DFT structures

Energy Above Hull

0.149 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

6
3 databases, 2 space groups
Uses

Applications

Where WBr4O is used.

Fundamental materials researchSolid-state chemistry studies
Reference

Frequently Asked Questions

Common questions about WBr4O, answered from cross-validated data.

What is WBr4O?

WBr4O is a semiconducting tungsten oxybromide compound that exists as a metastable phase with complex structural characteristics.

More questions
What is WBr4O used for?
WBr4O is used in fundamental materials research and solid-state chemistry studies.
What is the band gap of WBr4O?
WBr4O has a DFT-computed band gap of 1.12–1.46 eV across 6 reported structures.
Is WBr4O a metal, semiconductor, or insulator?
With a band gap up to 1.46 eV it is a semiconductor.
Is WBr4O thermodynamically stable?
WBr4O has a lowest energy above hull of 0.149 eV/atom (above hull).
How many polymorphs of WBr4O are known?
6 structures of WBr4O are reported across 3 databases, spanning 2 distinct space groups.
What elements does WBr4O contain?
WBr4O contains Br, O, and W (3 elements).
Where does the data for WBr4O come from?
WBr4O data is cross-referenced from latticegraph.
Comparison

How It Compares

As a specialized tungsten oxybromide, WBr4O represents a niche area of inorganic chemistry where the interplay between heavy transition metals and mixed-anion environments creates distinct electronic behaviors. Unlike more common, thermodynamically stable tungsten oxides, this compound occupies a unique space in the phase landscape, serving as an example of the structural diversity possible within complex transition metal systems.

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

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