Na2ZnSe2

Na2ZnSe2 is a thermodynamically stable semiconducting ternary chalcogenide composed of sodium, zinc, and selenium.

NaSeZn
Crystal structure of Na2ZnSe2
Ground-state structure · Materials Project
Overview

About Na2ZnSe2

Na2ZnSe2 is a ternary chalcogenide that exists as a thermodynamically stable phase on the convex hull. As a semiconducting material, it exhibits electronic properties that make it a subject of interest for fundamental solid-state research and potential optoelectronic applications.

With multiple reported structures across various databases, this compound represents a well-characterized member of its chemical family. Its structural flexibility and stable nature provide a foundation for investigating the interplay between alkali metal cations and zinc-chalcogenide frameworks.

At a glance

Key Properties

Cross-validated computational properties for Na2ZnSe2, aggregated across 3 databases.

Band Gap

2.14–2.24 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

10
3 databases, 2 space groups
Uses

Applications

Where Na2ZnSe2 is used.

Semiconductor researchSolid-state chemistry studiesMaterials science exploration
Reference

Frequently Asked Questions

Common questions about Na2ZnSe2, answered from cross-validated data.

What is Na2ZnSe2?

Na2ZnSe2 is a thermodynamically stable semiconducting ternary chalcogenide composed of sodium, zinc, and selenium.

More questions
What is Na2ZnSe2 used for?
Na2ZnSe2 is used in semiconductor research, solid-state chemistry studies, and materials science exploration.
What is the band gap of Na2ZnSe2?
Na2ZnSe2 has a DFT-computed band gap of 2.14–2.24 eV across 10 reported structures.
Is Na2ZnSe2 a metal, semiconductor, or insulator?
With a band gap up to 2.24 eV it is a semiconductor.
Is Na2ZnSe2 thermodynamically stable?
Yes — Na2ZnSe2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Na2ZnSe2 are known?
10 structures of Na2ZnSe2 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Na2ZnSe2 contain?
Na2ZnSe2 contains Na, Se, and Zn (3 elements).
Where does the data for Na2ZnSe2 come from?
Na2ZnSe2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a stable ternary chalcogenide, Na2ZnSe2 serves as a representative example of the structural diversity found in alkali-zinc-selenide systems. It occupies a distinct position in the chemical space of its class, offering a baseline for understanding the electronic and structural trends that govern similar semiconducting quaternary or ternary compounds.

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

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