N8Si4Zn4

N8Si4Zn4 is a thermodynamically stable ternary nitride semiconductor that functions as a wide-gap insulator.

Crystal structure of N8Si4Zn4 (orthorhombic, Pna21 (No. 33))
Ground-state structure · Materials Project
Overview

About N8Si4Zn4

N8Si4Zn4 is a complex nitride semiconductor characterized by its wide-gap insulating electronic profile. As a material that resides on the convex hull, it exhibits significant thermodynamic stability, making it a robust candidate for structural and electronic investigations within the broader family of nitride materials.

This compound is of particular interest to researchers exploring multi-element nitrides where silicon and zinc are integrated into a stable lattice. Its unique composition allows for the potential tuning of properties that are essential for next-generation semiconductor devices and specialized dielectric applications.

At a glance

Key Properties

Cross-validated computational properties for N8Si4Zn4, aggregated across 3 databases.

Band Gap

0.49–3.19 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

4
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for N8Si4Zn4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pna21 (No. 33)orthorhombic3.190.0000-9.9804.90
Cmce (No. 64)orthorhombic0.490.4600-9.5204.45
4.00
Pna21 (No. 33)
Uses

Applications

Where N8Si4Zn4 is used.

Semiconductor researchOptoelectronic device developmentDielectric materials
Reference

Frequently Asked Questions

Common questions about N8Si4Zn4, answered from cross-validated data.

What is N8Si4Zn4?

N8Si4Zn4 is a thermodynamically stable ternary nitride semiconductor that functions as a wide-gap insulator.

More questions
What is N8Si4Zn4 used for?
N8Si4Zn4 is used in semiconductor research, optoelectronic device development, and dielectric materials.
What is the band gap of N8Si4Zn4?
N8Si4Zn4 has a DFT-computed band gap of 0.49–3.19 eV across 4 reported structures.
Is N8Si4Zn4 a metal, semiconductor, or insulator?
With a wide band gap up to 3.19 eV it is an insulator / wide-band-gap material.
Is N8Si4Zn4 thermodynamically stable?
Yes — N8Si4Zn4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of N8Si4Zn4?
The lowest-energy reported polymorph of N8Si4Zn4 is orthorhombic symmetry, space group Pna21 (No. 33).
What is the density of N8Si4Zn4?
The computed density of the ground-state structure of N8Si4Zn4 is 4.90 g/cm³.
How many polymorphs of N8Si4Zn4 are known?
4 structures of N8Si4Zn4 are reported across 3 databases, spanning 2 distinct space groups.
What elements does N8Si4Zn4 contain?
N8Si4Zn4 contains N, Si, and Zn (3 elements).
Where does the data for N8Si4Zn4 come from?
N8Si4Zn4 data is cross-referenced from materials_project, omat24, aflow.
Comparison

How It Compares

Within the nitride semiconductors class.

Unlike the more commonly studied binary nitrides such as GaN or AlN, N8Si4Zn4 represents a more complex ternary arrangement. While GaN and InN are widely utilized for their specific optoelectronic properties, N8Si4Zn4 offers a distinct structural configuration that expands the design space for nitride-based semiconductors, positioning it as a specialized alternative to traditional binary systems.

Explore

Related Compounds

Other Nitride Semiconductors in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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