Se2Zn2

Zinc selenide · ZnSe

Zinc selenide is a stable semiconducting compound widely used in infrared optics and optoelectronic technologies.

Crystal structure of Se2Zn2 (cubic, F-43m (No. 216))
Ground-state structure · Materials Project
Overview

About Zinc selenide

Zinc selenide is a prominent II-VI semiconductor known for its robust thermodynamic stability and favorable electronic properties. As a member of the chalcogenide family, it serves as a critical material for applications requiring precise control over light-matter interactions.

Its structural versatility is highlighted by extensive experimental data, confirming its reliability in demanding environments. This compound is widely utilized in the manufacturing of optical components and advanced sensors where performance and material integrity are paramount.

At a glance

Key Properties

Cross-validated computational properties for Zinc selenide, aggregated across 5 databases.

Band Gap

1.17–1.97 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

38
5 databases, 15 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Se2Zn2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
F-43m (No. 216)cubic1.170.0000-3.3295.27
P63mc (No. 186)hexagonal1.200.0040-3.3255.27
P4/nmm (No. 129)tetragonal1.970.1600-3.1694.68
F-43m (No. 216)1.25
P4/nmm (No. 129)
R-3m (No. 166)
P63mc (No. 186)
Fd-3m (No. 227)
Imma (No. 74)
P4/nmm (No. 129)
P63/mmc (No. 194)
P63mc (No. 186)
Uses

Applications

Where Zinc selenide is used.

Infrared optical windowsLaser lensesBlue-green light-emitting diodesPhotodetectorsThin-film solar cells
Reference

Frequently Asked Questions

Common questions about Zinc selenide, answered from cross-validated data.

What is Se2Zn2?

Zinc selenide is a stable semiconducting compound widely used in infrared optics and optoelectronic technologies.

More questions
What is Se2Zn2 used for?
Zinc selenide (Se2Zn2) is used in infrared optical windows, laser lenses, blue-green light-emitting diodes, photodetectors, and thin-film solar cells.
What is the band gap of Se2Zn2?
Zinc selenide (Se2Zn2) has a DFT-computed band gap of 1.17–1.97 eV across 38 reported structures.
Is Se2Zn2 a metal, semiconductor, or insulator?
With a band gap up to 1.97 eV it is a semiconductor.
Is Se2Zn2 thermodynamically stable?
Yes — Zinc selenide (Se2Zn2) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Se2Zn2?
The lowest-energy reported polymorph of Zinc selenide (Se2Zn2) is cubic symmetry, space group F-43m (No. 216).
What is the density of Se2Zn2?
The computed density of the ground-state structure of Zinc selenide (Se2Zn2) is 5.27 g/cm³.
How many polymorphs of Se2Zn2 are known?
38 structures of Se2Zn2 are reported across 5 databases, spanning 15 distinct space groups.
What elements does Se2Zn2 contain?
Zinc selenide (Se2Zn2) contains Se and Zn (2 elements).
Where does the data for Se2Zn2 come from?
Se2Zn2 data is cross-referenced from materials_project, nomad, aflow.
Comparison

How It Compares

Within the ii-vi semiconductors class.

Within the class of II-VI semiconductors, Se2Zn2 stands out as a highly stable and well-characterized counterpart to materials like ZnS and CdSe. While it shares the fundamental semiconducting nature of its siblings, its specific combination of zinc and selenium provides a distinct balance of optical transparency and electronic performance that makes it a preferred choice over cadmium-based alternatives like CdTe or CdS in specific industrial applications.

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Related Compounds

Other II-VI Semiconductors in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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