KNaS

KNaS is a thermodynamically stable semiconducting ternary sulfide composed of potassium, sodium, and sulfur.

KNaS
Crystal structure of KNaS
Ground-state structure · Materials Project
Overview

About KNaS

KNaS is a ternary sulfide that exhibits semiconducting electronic behavior. As a thermodynamically stable phase located on the convex hull, it represents a robust configuration of potassium, sodium, and sulfur atoms that maintains structural integrity under standard conditions. The compound is characterized by a notable degree of structural diversity, with multiple reported configurations across various materials databases. This versatility makes it an intriguing subject for researchers investigating the interplay between alkali metal cations and chalcogenide frameworks in solid-state chemistry.

At a glance

Key Properties

Cross-validated computational properties for KNaS, aggregated across 4 databases.

Band Gap

2.49 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

4
4 databases, 1 space group
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting KNaS.

Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where KNaS is used.

Solid-state chemistry researchSemiconductor materials developmentFundamental structural studies
Reference

Frequently Asked Questions

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

What is KNaS?

KNaS is a thermodynamically stable semiconducting ternary sulfide composed of potassium, sodium, and sulfur.

More questions
What is KNaS used for?
KNaS is used in solid-state chemistry research, semiconductor materials development, and fundamental structural studies.
What is the band gap of KNaS?
KNaS has a DFT-computed band gap of 2.49 eV across 4 reported structures.
Is KNaS a metal, semiconductor, or insulator?
With a band gap up to 2.49 eV it is a semiconductor.
Is KNaS thermodynamically stable?
Yes — KNaS sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of KNaS are known?
4 structures of KNaS are reported across 4 databases, spanning 1 distinct space group.
How is KNaS synthesized?
Literature-reported routes for KNaS include solid state.
What elements does KNaS contain?
KNaS contains K, Na, and S (3 elements).
Where does the data for KNaS come from?
KNaS data is cross-referenced from latticegraph.
Comparison

How It Compares

As a ternary sulfide, KNaS occupies a distinct niche in the landscape of alkali-metal chalcogenides, serving as a foundational example of how combining different alkali cations can stabilize specific lattice arrangements in sulfur-based systems.

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

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