Cs4P4Si2

Cs4P4Si2 is a thermodynamically stable semiconducting compound formed from cesium, phosphorus, and silicon.

CsPSi
Crystal structure of Cs4P4Si2
Ground-state structure · Materials Project
Overview

About Cs4P4Si2

Cs4P4Si2 is a complex ternary compound composed of cesium, phosphorus, and silicon. As a thermodynamically stable phase located on the convex hull, it represents a robust crystalline arrangement that maintains structural integrity under standard conditions.

This material exhibits semiconducting electronic characteristics, making it a subject of interest for researchers investigating electronic and optoelectronic properties in alkali-metal pnictide-silicides. Its existence across multiple structural databases highlights its significance as a well-defined crystalline phase.

At a glance

Key Properties

Cross-validated computational properties for Cs4P4Si2, aggregated across 3 databases.

Band Gap

1.27 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

3
3 databases, 1 space group
Uses

Applications

Where Cs4P4Si2 is used.

Semiconductor researchSolid-state chemistryMaterials science exploration
Reference

Frequently Asked Questions

Common questions about Cs4P4Si2, answered from cross-validated data.

What is Cs4P4Si2?

Cs4P4Si2 is a thermodynamically stable semiconducting compound formed from cesium, phosphorus, and silicon.

More questions
What is Cs4P4Si2 used for?
Cs4P4Si2 is used in semiconductor research, solid-state chemistry, and materials science exploration.
What is the band gap of Cs4P4Si2?
Cs4P4Si2 has a DFT-computed band gap of 1.27 eV across 3 reported structures.
Is Cs4P4Si2 a metal, semiconductor, or insulator?
With a band gap up to 1.27 eV it is a semiconductor.
Is Cs4P4Si2 thermodynamically stable?
Yes — Cs4P4Si2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Cs4P4Si2 are known?
3 structures of Cs4P4Si2 are reported across 3 databases, spanning 1 distinct space group.
What elements does Cs4P4Si2 contain?
Cs4P4Si2 contains Cs, P, and Si (3 elements).
Where does the data for Cs4P4Si2 come from?
Cs4P4Si2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique ternary phase within the cesium-phosphorus-silicon system, Cs4P4Si2 serves as a foundational example of how these elements combine to form stable semiconducting architectures. It stands as a distinct material that contributes to the broader understanding of complex pnictide-silicide chemistry.

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

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