Al2Zn2S5

Al2Zn2S5 is a wide-gap insulating sulfide that shows potential for synthesis due to its favorable thermodynamic stability.

AlSZn
Crystal structure of Al2Zn2S5
Ground-state structure · Materials Project
Overview

About Al2Zn2S5

Al2Zn2S5 is an insulating ternary sulfide composed of aluminum, zinc, and sulfur. As a wide-gap material, it is characterized by its electronic properties that make it a subject of interest for fundamental structural research within the sulfide family.

Given its near-hull thermodynamic stability, this compound is considered a promising candidate for experimental synthesis. The existence of multiple reported structural variations across databases underscores its complexity and the ongoing interest in mapping its potential phases.

At a glance

Key Properties

Cross-validated computational properties for Al2Zn2S5, aggregated across 3 databases.

Band Gap

0.03–3.56 eV
Range across DFT structures

Energy Above Hull

0.013 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

19
3 databases, 6 space groups
Uses

Applications

Where Al2Zn2S5 is used.

Electronic materials researchSemiconductor development studies
Reference

Frequently Asked Questions

Common questions about Al2Zn2S5, answered from cross-validated data.

What is Al2Zn2S5?

Al2Zn2S5 is a wide-gap insulating sulfide that shows potential for synthesis due to its favorable thermodynamic stability.

More questions
What is Al2Zn2S5 used for?
Al2Zn2S5 is used in electronic materials research and semiconductor development studies.
What is the band gap of Al2Zn2S5?
Al2Zn2S5 has a DFT-computed band gap of 0.03–3.56 eV across 19 reported structures.
Is Al2Zn2S5 a metal, semiconductor, or insulator?
With a wide band gap up to 3.56 eV it is an insulator / wide-band-gap material.
Is Al2Zn2S5 thermodynamically stable?
Al2Zn2S5 has a lowest energy above hull of 0.013 eV/atom (near hull (likely stable)).
How many polymorphs of Al2Zn2S5 are known?
19 structures of Al2Zn2S5 are reported across 3 databases, spanning 6 distinct space groups.
What elements does Al2Zn2S5 contain?
Al2Zn2S5 contains Al, S, and Zn (3 elements).
Where does the data for Al2Zn2S5 come from?
Al2Zn2S5 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique ternary sulfide, Al2Zn2S5 occupies a distinct position in materials research. While it lacks direct siblings in this specific classification, its structural diversity and proximity to thermodynamic stability distinguish it as a notable subject for those exploring new wide-gap chalcogenide semiconductors.

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

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