Au2Se2

Au2Se2 is a stable, semiconducting compound composed of gold and selenium that is frequently studied for its diverse structural configurations.

AuSe
Crystal structure of Au2Se2
Ground-state structure · Materials Project
Overview

About Au2Se2

Au2Se2 is a thermodynamically stable gold selenide that sits firmly on the convex hull, indicating significant structural robustness. As a semiconducting material, it offers a unique electronic profile that distinguishes it from purely metallic gold alloys or insulating selenides.

The compound is characterized by a high degree of structural diversity, with numerous reported configurations across major materials databases. This extensive data availability highlights its importance as a subject of fundamental research in chalcogenide chemistry and potential semiconductor applications.

At a glance

Key Properties

Cross-validated computational properties for Au2Se2, aggregated across 4 databases.

Band Gap

0.26 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

39
4 databases, 14 space groups
Uses

Applications

Where Au2Se2 is used.

Semiconductor researchChalcogenide materials developmentSolid-state electronics exploration
Reference

Frequently Asked Questions

Common questions about Au2Se2, answered from cross-validated data.

What is Au2Se2?

Au2Se2 is a stable, semiconducting compound composed of gold and selenium that is frequently studied for its diverse structural configurations.

More questions
What is Au2Se2 used for?
Au2Se2 is used in semiconductor research, chalcogenide materials development, and solid-state electronics exploration.
What is the band gap of Au2Se2?
Au2Se2 has a DFT-computed band gap of 0.26 eV across 39 reported structures.
Is Au2Se2 a metal, semiconductor, or insulator?
With a band gap up to 0.26 eV it is a semiconductor.
Is Au2Se2 thermodynamically stable?
Yes — Au2Se2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Au2Se2 are known?
39 structures of Au2Se2 are reported across 4 databases, spanning 14 distinct space groups.
What elements does Au2Se2 contain?
Au2Se2 contains Au and Se (2 elements).
Where does the data for Au2Se2 come from?
Au2Se2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct binary compound, Au2Se2 serves as a foundational example of gold-based chalcogenide stability. Without direct siblings in this specific classification, it represents a standalone reference point for understanding how gold and selenium interact to form stable, semiconducting crystalline frameworks.

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

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