Hg3Se4O5

Hg3Se4O5 is a metastable, semiconducting mercury selenium oxide used primarily in fundamental materials research.

HgOSe
Crystal structure of Hg3Se4O5
Ground-state structure · Materials Project
Overview

About Hg3Se4O5

Hg3Se4O5 is a complex mercury selenium oxide that exhibits semiconducting electronic behavior. As a metastable phase, it represents a unique configuration within the mercury-chalcogen-oxygen chemical space, offering researchers a distinct structural profile for investigation. Its existence is documented across multiple structural databases, highlighting its significance in solid-state chemistry studies. The material is primarily utilized in academic research settings to better understand the coordination environments of mercury in complex oxide frameworks. By exploring its metastable nature, scientists can gain insights into the synthesis and stability limits of mercury-based compounds, which is vital for developing specialized electronic or optical materials.

At a glance

Key Properties

Cross-validated computational properties for Hg3Se4O5, aggregated across 4 databases.

Band Gap

1.83 eV
Range across DFT structures

Energy Above Hull

0.049 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

6
4 databases, 2 space groups
Uses

Applications

Where Hg3Se4O5 is used.

Solid-state chemistry researchMaterials science characterizationFundamental electronic property studies
Reference

Frequently Asked Questions

Common questions about Hg3Se4O5, answered from cross-validated data.

What is Hg3Se4O5?

Hg3Se4O5 is a metastable, semiconducting mercury selenium oxide used primarily in fundamental materials research.

More questions
What is Hg3Se4O5 used for?
Hg3Se4O5 is used in solid-state chemistry research, materials science characterization, and fundamental electronic property studies.
What is the band gap of Hg3Se4O5?
Hg3Se4O5 has a DFT-computed band gap of 1.83 eV across 6 reported structures.
Is Hg3Se4O5 a metal, semiconductor, or insulator?
With a band gap up to 1.83 eV it is a semiconductor.
Is Hg3Se4O5 thermodynamically stable?
Hg3Se4O5 has a lowest energy above hull of 0.049 eV/atom (metastable).
How many polymorphs of Hg3Se4O5 are known?
6 structures of Hg3Se4O5 are reported across 4 databases, spanning 2 distinct space groups.
What elements does Hg3Se4O5 contain?
Hg3Se4O5 contains Hg, O, and Se (3 elements).
Where does the data for Hg3Se4O5 come from?
Hg3Se4O5 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a specialized mercury selenium oxide, this compound occupies a niche position in materials science. Unlike more common or stable binary oxides, Hg3Se4O5 serves as a critical example of the structural diversity possible within mercury-containing systems, providing a reference point for understanding how complex stoichiometry influences electronic properties in metastable phases.

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

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