SrWN3

SrWN3 is a metastable semiconducting ternary nitride containing strontium and tungsten.

NSrW
Crystal structure of SrWN3 (triclinic, P1 (No. 1))
Ground-state structure · Materials Project
Overview

About SrWN3

SrWN3 is a complex ternary nitride composed of strontium, tungsten, and nitrogen. As a semiconducting material, it represents an intriguing candidate for electronic and optoelectronic research, where its unique composition offers distinct pathways for band structure engineering.

Despite its metastable nature, the compound has attracted significant interest, as evidenced by its presence across multiple structural databases. Its synthesis and stability are subjects of ongoing investigation, aiming to harness its properties for specialized technological integration.

At a glance

Key Properties

Cross-validated computational properties for SrWN3, aggregated across 3 databases.

Band Gap

1.11–1.27 eV
Range across DFT structures

Energy Above Hull

0.056 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

10
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for SrWN3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P1 (No. 1)triclinic1.110.0555-19.6067.20
C2/m (No. 12)monoclinic1.270.0741-19.5886.81
P1 (No. 1)
C2/m (No. 12)
C2/m (No. 12)Monoclinic6.66
P1 (No. 1)Triclinic7.05
C2/m (No. 12)Monoclinic6.96
C2/m (No. 12)Monoclinic6.74
P1 (No. 1)Triclinic7.38
P1 (No. 1)Triclinic7.14
Uses

Applications

Where SrWN3 is used.

Semiconductor researchOptoelectronic material developmentAdvanced materials synthesis
Reference

Frequently Asked Questions

Common questions about SrWN3, answered from cross-validated data.

What is SrWN3?

SrWN3 is a metastable semiconducting ternary nitride containing strontium and tungsten.

More questions
What is SrWN3 used for?
SrWN3 is used in semiconductor research, optoelectronic material development, and advanced materials synthesis.
What is the band gap of SrWN3?
SrWN3 has a DFT-computed band gap of 1.11–1.27 eV across 10 reported structures.
Is SrWN3 a metal, semiconductor, or insulator?
With a band gap up to 1.27 eV it is a semiconductor.
Is SrWN3 thermodynamically stable?
SrWN3 has a lowest energy above hull of 0.056 eV/atom (metastable).
What is the crystal structure of SrWN3?
The lowest-energy reported polymorph of SrWN3 is triclinic symmetry, space group P1 (No. 1).
What is the density of SrWN3?
The computed density of the ground-state structure of SrWN3 is 7.20 g/cm³.
How many polymorphs of SrWN3 are known?
10 structures of SrWN3 are reported across 3 databases, spanning 2 distinct space groups.
What elements does SrWN3 contain?
SrWN3 contains N, Sr, and W (3 elements).
Where does the data for SrWN3 come from?
SrWN3 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a unique ternary nitride, SrWN3 occupies a specialized niche within the broader landscape of semiconducting materials. While many nitrides are characterized by their robust stability, this compound stands out due to its metastable state, which provides a distinct set of challenges and opportunities for researchers focused on precision synthesis and phase control.

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

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