CaWN3

CaWN3 is a metastable semiconducting ternary nitride compound used in materials science research.

CaNW
Crystal structure of CaWN3
Ground-state structure · Materials Project
Overview

About CaWN3

CaWN3 is a ternary nitride compound that exhibits semiconducting electronic properties. As a metastable material, it represents a unique phase in the landscape of metal nitrides, offering researchers a distinct structural configuration for investigating electronic behavior in non-oxide ceramics. Its existence across multiple databases underscores its significance in the exploration of complex nitrogen-based frameworks. The compound is primarily of interest in fundamental materials science, where its specific electronic character is studied to understand the interplay between calcium, tungsten, and nitrogen within a crystalline lattice. Its metastable nature suggests that synthesis conditions are critical for stabilizing the material, making it a subject of interest for those developing novel inorganic semiconductors.

At a glance

Key Properties

Cross-validated computational properties for CaWN3, aggregated across 3 databases.

Band Gap

0.56 eV
Range across DFT structures

Energy Above Hull

0.091 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where CaWN3 is used.

Materials science researchSemiconductor development
Reference

Frequently Asked Questions

Common questions about CaWN3, answered from cross-validated data.

What is CaWN3?

CaWN3 is a metastable semiconducting ternary nitride compound used in materials science research.

More questions
What is CaWN3 used for?
CaWN3 is used in materials science research and semiconductor development.
What is the band gap of CaWN3?
CaWN3 has a DFT-computed band gap of 0.56 eV across 5 reported structures.
Is CaWN3 a metal, semiconductor, or insulator?
With a band gap up to 0.56 eV it is a semiconductor.
Is CaWN3 thermodynamically stable?
CaWN3 has a lowest energy above hull of 0.091 eV/atom (metastable).
How many polymorphs of CaWN3 are known?
5 structures of CaWN3 are reported across 3 databases, spanning 1 distinct space group.
What elements does CaWN3 contain?
CaWN3 contains Ca, N, and W (3 elements).
Where does the data for CaWN3 come from?
CaWN3 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a specialized ternary nitride, CaWN3 occupies a niche position within the broader category of metal nitrides, serving as a distinct example of how transition metals like tungsten can be integrated with alkaline earth metals to form semiconducting structures.

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

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