SrReN3

SrReN3 is a stable, semiconducting ternary nitride material composed of strontium, rhenium, and nitrogen.

NReSr
Crystal structure of SrReN3 (monoclinic, C2/c (No. 15))
Ground-state structure · Materials Project
Overview

About SrReN3

SrReN3 is a complex nitride material composed of strontium, rhenium, and nitrogen. As a thermodynamically stable compound residing on the convex hull, it represents a robust structural configuration within its chemical system.

This material exhibits semiconducting electronic behavior, making it a subject of interest for researchers investigating new functional nitrides. Its stability and distinct electronic profile suggest potential utility in specialized solid-state devices.

At a glance

Key Properties

Cross-validated computational properties for SrReN3, aggregated across 3 databases.

Band Gap

2.00 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for SrReN3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/c (No. 15)monoclinic2.000.0000-8.5576.16
C2/c (No. 15)Monoclinic5.98
C2/c (No. 15)Monoclinic6.26
C2/c (No. 15)Monoclinic6.04
C2/c (No. 15)
Uses

Applications

Where SrReN3 is used.

Semiconductor researchSolid-state electronic materials development
Reference

Frequently Asked Questions

Common questions about SrReN3, answered from cross-validated data.

What is SrReN3?

SrReN3 is a stable, semiconducting ternary nitride material composed of strontium, rhenium, and nitrogen.

More questions
What is SrReN3 used for?
SrReN3 is used in semiconductor research and solid-state electronic materials development.
What is the band gap of SrReN3?
SrReN3 has a DFT-computed band gap of 2.00 eV across 5 reported structures.
Is SrReN3 a metal, semiconductor, or insulator?
With a band gap up to 2.00 eV it is a semiconductor.
Is SrReN3 thermodynamically stable?
Yes — SrReN3 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of SrReN3?
The lowest-energy reported polymorph of SrReN3 is monoclinic symmetry, space group C2/c (No. 15).
What is the density of SrReN3?
The computed density of the ground-state structure of SrReN3 is 6.16 g/cm³.
How many polymorphs of SrReN3 are known?
5 structures of SrReN3 are reported across 3 databases, spanning 1 distinct space group.
What elements does SrReN3 contain?
SrReN3 contains N, Re, and Sr (3 elements).
Where does the data for SrReN3 come from?
SrReN3 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

As a unique ternary nitride, SrReN3 serves as a foundational example of how rhenium can be incorporated into stable strontium-based lattices to achieve semiconducting properties.

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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