Au2K6Se4

Au2K6Se4 is a thermodynamically stable, semiconducting ternary chalcogenide composed of gold, potassium, and selenium.

AuKSe
Crystal structure of Au2K6Se4
Ground-state structure · Materials Project
Overview

About Au2K6Se4

Au2K6Se4 is a complex ternary chalcogenide that exhibits semiconducting electronic behavior. As a thermodynamically stable compound residing on the convex hull, it represents a robust structural arrangement of gold, potassium, and selenium atoms. Its existence is supported by multiple structural reports across major materials databases, highlighting its significance in solid-state chemistry.

This material serves as a subject of interest for researchers investigating the interplay between noble metals and alkali chalcogenides. Its stable configuration makes it a valuable candidate for fundamental studies into electronic band structures and potential applications in specialized optoelectronic or ion-conducting systems.

At a glance

Key Properties

Cross-validated computational properties for Au2K6Se4, aggregated across 3 databases.

Band Gap

2.05 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

4
3 databases, 1 space group
Uses

Applications

Where Au2K6Se4 is used.

Solid-state researchSemiconductor materials developmentFundamental materials science
Reference

Frequently Asked Questions

Common questions about Au2K6Se4, answered from cross-validated data.

What is Au2K6Se4?

Au2K6Se4 is a thermodynamically stable, semiconducting ternary chalcogenide composed of gold, potassium, and selenium.

More questions
What is Au2K6Se4 used for?
Au2K6Se4 is used in solid-state research, semiconductor materials development, and fundamental materials science.
What is the band gap of Au2K6Se4?
Au2K6Se4 has a DFT-computed band gap of 2.05 eV across 4 reported structures.
Is Au2K6Se4 a metal, semiconductor, or insulator?
With a band gap up to 2.05 eV it is a semiconductor.
Is Au2K6Se4 thermodynamically stable?
Yes — Au2K6Se4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Au2K6Se4 are known?
4 structures of Au2K6Se4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Au2K6Se4 contain?
Au2K6Se4 contains Au, K, and Se (3 elements).
Where does the data for Au2K6Se4 come from?
Au2K6Se4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct ternary phase, Au2K6Se4 occupies a unique position within the broader landscape of gold-based chalcogenides. Unlike more common binary gold selenides, this compound leverages the presence of potassium to stabilize its complex lattice, showcasing the structural diversity possible when incorporating alkali metals into gold-chalcogen frameworks.

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

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