Cu2K2Nd4S8

Cu2K2Nd4S8 is a thermodynamically stable, semiconducting quaternary sulfide composed of copper, potassium, neodymium, and sulfur.

CuKNdS
Crystal structure of Cu2K2Nd4S8
Ground-state structure · Materials Project
Overview

About Cu2K2Nd4S8

Cu2K2Nd4S8 is a complex quaternary sulfide characterized by its semiconducting electronic nature. As a thermodynamically stable phase residing on the convex hull, it represents a robust structural arrangement of copper, potassium, neodymium, and sulfur atoms. Its stability suggests potential for reliable performance in specialized solid-state applications.

The compound is recognized for its structural diversity, appearing across multiple independent databases. This prevalence highlights its significance as a focal point for researchers investigating the interplay between rare-earth elements and chalcogenide frameworks in electronic materials.

At a glance

Key Properties

Cross-validated computational properties for Cu2K2Nd4S8, aggregated across 3 databases.

Band Gap

0.91 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 Cu2K2Nd4S8 is used.

Solid-state electronic materials researchChalcogenide semiconductor development
Reference

Frequently Asked Questions

Common questions about Cu2K2Nd4S8, answered from cross-validated data.

What is Cu2K2Nd4S8?

Cu2K2Nd4S8 is a thermodynamically stable, semiconducting quaternary sulfide composed of copper, potassium, neodymium, and sulfur.

More questions
What is Cu2K2Nd4S8 used for?
Cu2K2Nd4S8 is used in solid-state electronic materials research and chalcogenide semiconductor development.
What is the band gap of Cu2K2Nd4S8?
Cu2K2Nd4S8 has a DFT-computed band gap of 0.91 eV across 4 reported structures.
Is Cu2K2Nd4S8 a metal, semiconductor, or insulator?
With a band gap up to 0.91 eV it is a semiconductor.
Is Cu2K2Nd4S8 thermodynamically stable?
Yes — Cu2K2Nd4S8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Cu2K2Nd4S8 are known?
4 structures of Cu2K2Nd4S8 are reported across 3 databases, spanning 1 distinct space group.
What elements does Cu2K2Nd4S8 contain?
Cu2K2Nd4S8 contains Cu, K, Nd, and S (4 elements).
Where does the data for Cu2K2Nd4S8 come from?
Cu2K2Nd4S8 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique quaternary sulfide, Cu2K2Nd4S8 serves as a representative example of how rare-earth ions can be integrated into complex sulfur-based lattices to achieve stable, semiconducting behavior. While it stands as a distinct composition, it contributes to the broader understanding of how alkali and transition metals tune the electronic properties of rare-earth chalcogenides.

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

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