Sr2Si5N8

Sr2Si5N8 is a thermodynamically stable, wide-gap nitride semiconductor used primarily in the development of high-performance phosphors and optoelectronic materials.

Crystal structure of Sr2Si5N8 (orthorhombic, Pmn21 (No. 31))
Ground-state structure · Materials Project
Overview

About Sr2Si5N8

Sr2Si5N8 is a robust nitride semiconductor characterized by its wide-gap insulating nature. As a thermodynamically stable phase located on the convex hull, it represents a highly reliable material for structural and electronic integration in demanding environments. Its unique crystalline framework allows for precise tuning of physical properties, making it a subject of significant interest for materials engineering.

This compound is primarily utilized in the development of advanced phosphors and optoelectronic devices. Due to its structural integrity and electronic behavior, it serves as a foundational material for high-performance light-emitting technologies, bridging the gap between traditional nitride semiconductors and specialized insulating applications.

At a glance

Key Properties

Cross-validated computational properties for Sr2Si5N8, aggregated across 2 databases.

Band Gap

3.29–3.41 eV
Range across DFT structures · ground state: wide gap

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

Stable
3 DFT sources

Structures

2
2 databases, 1 space group
Validation

Cross-Source DFT Agreement

How well independent DFT databases agree on the thermodynamics of Sr2Si5N8. Tight agreement means computed properties can be trusted without re-running calculations.

Agreement Score

1.00 / 1.00
Trust tier: high

Hull Spread

0.000 eV
EAH spread across sources

Sources Compared

3
jarvis, materials_project, oqmd

Space Group Consensus

All match
Crystallography

Reported Structures

Lowest-energy structures reported for Sr2Si5N8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
——3.410.0000-1.300—
Pmn21 (No. 31)orthorhombic3.290.0000-1.320—
Pmn21 (No. 31)orthorhombic3.200.0000-11.2323.90
Pmn21 (No. 31)orthorhombic———3.90
Pmn21 (No. 31)orthorhombic———7.64
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting Sr2Si5N8.

Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where Sr2Si5N8 is used.

LED phosphorsOptoelectronic devicesSolid-state lighting
Intellectual Property

Patent Landscape

1 patent reference Sr2Si5N8 or close compositional variants.

PatentTitleAssigneeGranted
9023240Silicon nitride powder for siliconnitride phosphor, CaAlSiN3 phosphor using same, Sr2Si5N8 phosphor using same——
Reference

Frequently Asked Questions

Common questions about Sr2Si5N8, answered from cross-validated data.

What is Sr2Si5N8?

Sr2Si5N8 is a thermodynamically stable, wide-gap nitride semiconductor used primarily in the development of high-performance phosphors and optoelectronic materials.

More questions
What is Sr2Si5N8 used for?
Sr2Si5N8 is used in lED phosphors, optoelectronic devices, and solid-state lighting.
What is the band gap of Sr2Si5N8?
Sr2Si5N8 has a DFT-computed band gap of 3.29–3.41 eV across 2 reported structures. Standard DFT underestimates band gaps, so the measured gap is typically larger.
Is Sr2Si5N8 a metal, semiconductor, or insulator?
DFT predicts a wide band gap of up to 3.41 eV (an insulator or wide-band-gap material).
Is Sr2Si5N8 thermodynamically stable?
Yes — Sr2Si5N8 sits on the convex hull (energy above hull 0 eV/atom), i.e. stable.
What is the crystal structure of Sr2Si5N8?
The reference structure of Sr2Si5N8 is orthorhombic symmetry, space group Pmn21 (No. 31).
How many polymorphs of Sr2Si5N8 are known?
2 structures of Sr2Si5N8 are reported across 2 databases, spanning 1 distinct space group.
How is Sr2Si5N8 synthesized?
Literature-reported routes for Sr2Si5N8 include solid state (3 procedures documented).
What elements does Sr2Si5N8 contain?
Sr2Si5N8 contains N, Si, and Sr (3 elements).
Where does the data for Sr2Si5N8 come from?
Sr2Si5N8 data is cross-referenced from oqmd, jarvis, materials_project, cod.
Comparison

How It Compares

Within the nitride semiconductors class.

While members like GaN and AlN are widely recognized for their role in high-frequency power electronics and blue light emission, Sr2Si5N8 occupies a distinct niche as a complex ternary nitride. Unlike the binary nitrides such as BN or InN, this compound offers a more intricate lattice structure that provides unique host-lattice capabilities for luminescence, setting it apart from the simpler binary systems within the broader nitride semiconductor class.

Explore

Related Compounds

Other Nitride Semiconductors in the database.

Data sources & attribution
  • oqmd — Data from the OQMD (oqmd.org). Cite: Saal et al., JOM 65, 1501 (2013); Kirklin et al., npj Comp. Mater. 1, 15010 (2015). (CC-BY-4.0)
  • jarvis — Data from JARVIS (jarvis.nist.gov), NIST. Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020). (LicenseRef-US-Gov-PD)
  • materials_project — Data from the Materials Project (materialsproject.org). Cite: Jain et al., APL Materials 1, 011002 (2013). (CC-BY-4.0)
  • cod — Data from the Crystallography Open Database (crystallography.net/cod/). Cite: Grazulis et al., J. Appl. Cryst. 42, 726 (2009). (CC0-1.0)

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