WSe2

Tungsten diselenide · Tungsten(IV) selenide

Tungsten diselenide is a stable, semiconducting transition-metal dichalcogenide used extensively in advanced electronics and optoelectronic research.

Crystal structure of WSe2 (hexagonal, P63/mmc (No. 194))
Ground-state structure · Materials Project
Overview

About Tungsten diselenide

WSe2 is a layered transition-metal dichalcogenide that functions as a robust semiconductor. Its structural integrity is confirmed by its position on the convex hull, making it a thermodynamically stable material of significant interest for fundamental research and industrial development. The compound is widely utilized in the exploration of thin-film electronics and light-harvesting systems. Due to its well-defined electronic character, it serves as a foundational material for investigating quantum phenomena and high-performance electronic devices.

At a glance

Key Properties

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

Band Gap

1.23–1.54 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

101
3 databases, 16 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for WSe2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P63/mmc (No. 194)hexagonal1.450.0000-27.2678.66
P-3m1 (No. 164)trigonal1.520.0043-27.2636.54
P-6m2 (No. 187)hexagonal1.230.0055-27.2626.00
P-3m1 (No. 164)trigonal1.520.0082-27.2594.95
P-6m2 (No. 187)hexagonal1.540.0158-27.2523.57
C2/m (No. 12)Monoclinic10.49
P-6m2 (No. 187)
P-6m2 (No. 187)
P-3m1 (No. 164)
C2/m (No. 12)Monoclinic13.05
C2/m (No. 12)Monoclinic6.17
Amm2 (No. 38)Orthorhombic8.01
Uses

Applications

Where Tungsten diselenide is used.

Field-effect transistorsPhotodetectorsLight-emitting diodesPhotovoltaic devicesCatalysis
Reference

Frequently Asked Questions

Common questions about Tungsten diselenide, answered from cross-validated data.

What is WSe2?

Tungsten diselenide is a stable, semiconducting transition-metal dichalcogenide used extensively in advanced electronics and optoelectronic research.

More questions
What is WSe2 used for?
Tungsten diselenide (WSe2) is used in field-effect transistors, photodetectors, light-emitting diodes, photovoltaic devices, and catalysis.
What is the band gap of WSe2?
Tungsten diselenide (WSe2) has a DFT-computed band gap of 1.23–1.54 eV across 101 reported structures.
Is WSe2 a metal, semiconductor, or insulator?
With a band gap up to 1.54 eV it is a semiconductor.
Is WSe2 thermodynamically stable?
Yes — Tungsten diselenide (WSe2) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of WSe2?
The lowest-energy reported polymorph of Tungsten diselenide (WSe2) is hexagonal symmetry, space group P63/mmc (No. 194).
What is the density of WSe2?
The computed density of the ground-state structure of Tungsten diselenide (WSe2) is 8.66 g/cm³.
How many polymorphs of WSe2 are known?
101 structures of WSe2 are reported across 3 databases, spanning 16 distinct space groups.
What elements does WSe2 contain?
Tungsten diselenide (WSe2) contains Se and W (2 elements).
Where does the data for WSe2 come from?
WSe2 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the transition-metal dichalcogenides class.

Within the family of transition-metal dichalcogenides, WSe2 shares structural similarities with MoSe2 and MoS2, yet it is distinguished by its unique electronic response and heavy metal center. While materials like ReS2 or ReSe2 exhibit lower symmetry, WSe2 maintains a highly ordered lattice that facilitates consistent performance in semiconductor applications compared to more complex phases like Mo3S4.

Explore

Related Compounds

Other Transition-Metal Dichalcogenides in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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