Au4Cl16K4

Au4Cl16K4 is a thermodynamically stable, semiconducting inorganic compound containing gold, chlorine, and potassium.

AuClK
Crystal structure of Au4Cl16K4
Ground-state structure · Materials Project
Overview

About Au4Cl16K4

Au4Cl16K4 is a complex inorganic compound composed of gold, chlorine, and potassium. As a thermodynamically stable phase located on the convex hull, it represents a robust configuration of these elements that maintains structural integrity under standard conditions.

This material exhibits semiconducting electronic character, making it a subject of interest for researchers investigating the interplay between heavy metal centers and halide coordination. Its existence across multiple crystallographic databases highlights its significance as a well-defined chemical entity in inorganic chemistry.

At a glance

Key Properties

Cross-validated computational properties for Au4Cl16K4, aggregated across 3 databases.

Band Gap

1.43 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, 2 space groups
Uses

Applications

Where Au4Cl16K4 is used.

Inorganic synthesis researchCoordination chemistry studiesSemiconductor materials exploration
Reference

Frequently Asked Questions

Common questions about Au4Cl16K4, answered from cross-validated data.

What is Au4Cl16K4?

Au4Cl16K4 is a thermodynamically stable, semiconducting inorganic compound containing gold, chlorine, and potassium.

More questions
What is Au4Cl16K4 used for?
Au4Cl16K4 is used in inorganic synthesis research, coordination chemistry studies, and semiconductor materials exploration.
What is the band gap of Au4Cl16K4?
Au4Cl16K4 has a DFT-computed band gap of 1.43 eV across 4 reported structures.
Is Au4Cl16K4 a metal, semiconductor, or insulator?
With a band gap up to 1.43 eV it is a semiconductor.
Is Au4Cl16K4 thermodynamically stable?
Yes — Au4Cl16K4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Au4Cl16K4 are known?
4 structures of Au4Cl16K4 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Au4Cl16K4 contain?
Au4Cl16K4 contains Au, Cl, and K (3 elements).
Where does the data for Au4Cl16K4 come from?
Au4Cl16K4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct gold-based halide, Au4Cl16K4 serves as a foundational example of complex metal-chloride coordination chemistry. It occupies a unique position within the broader landscape of gold-potassium-chlorine systems, offering a stable framework for studying semiconducting behavior in halide-rich environments.

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

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