AlPS4

AlPS4 is a thermodynamically stable semiconducting material composed of aluminum, phosphorus, and sulfur.

AlPS
Crystal structure of AlPS4
Ground-state structure · Materials Project
Overview

About AlPS4

AlPS4 is a semiconducting compound composed of aluminum, phosphorus, and sulfur. As a thermodynamically stable material located on the convex hull, it represents a robust phase within its chemical system, making it a subject of significant interest for structural and electronic investigations. Its existence across multiple reported structures suggests a versatile architectural framework that warrants further exploration in solid-state chemistry. The material's electronic character positions it as a candidate for specialized applications where semiconducting properties are required. Its stability profile indicates that it maintains its integrity under standard conditions, providing a reliable platform for researchers to study the interplay between its constituent elements.

At a glance

Key Properties

Cross-validated computational properties for AlPS4, aggregated across 3 databases.

Band Gap

2.61–2.84 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

18
3 databases, 6 space groups
Uses

Applications

Where AlPS4 is used.

semiconductor researchsolid-state chemistry studiesmaterials science exploration
Reference

Frequently Asked Questions

Common questions about AlPS4, answered from cross-validated data.

What is AlPS4?

AlPS4 is a thermodynamically stable semiconducting material composed of aluminum, phosphorus, and sulfur.

More questions
What is AlPS4 used for?
AlPS4 is used in semiconductor research, solid-state chemistry studies, and materials science exploration.
What is the band gap of AlPS4?
AlPS4 has a DFT-computed band gap of 2.61–2.84 eV across 18 reported structures.
Is AlPS4 a metal, semiconductor, or insulator?
With a band gap up to 2.84 eV it is a semiconductor.
Is AlPS4 thermodynamically stable?
Yes — AlPS4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of AlPS4 are known?
18 structures of AlPS4 are reported across 3 databases, spanning 6 distinct space groups.
What elements does AlPS4 contain?
AlPS4 contains Al, P, and S (3 elements).
Where does the data for AlPS4 come from?
AlPS4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a thermodynamically stable semiconducting phase, AlPS4 serves as a foundational reference point for exploring the broader aluminum-phosphorus-sulfur system. While specific comparative data for siblings in this class are limited, its position on the convex hull distinguishes it as a highly favorable structural configuration compared to metastable alternatives that may exist within this chemical space.

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

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