MgGeN2

MgGeN2 is a thermodynamically stable semiconducting nitride compound.

GeMgN
Crystal structure of MgGeN2 (orthorhombic, Pna21 (No. 33))
Ground-state structure · Materials Project
Overview

About MgGeN2

MgGeN2 is a semiconducting ternary nitride that occupies a stable position on the convex hull, indicating robust thermodynamic favorability. Its composition of magnesium, germanium, and nitrogen allows for a unique electronic structure that distinguishes it from more common binary semiconductors. The material is characterized by its structural versatility, with multiple reported configurations across crystallographic databases. This diversity in structural arrangements underscores its potential as a functional material in specialized semiconductor research.

At a glance

Key Properties

Cross-validated computational properties for MgGeN2, aggregated across 3 databases.

Band Gap

2.64 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, 3 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for MgGeN2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pna21 (No. 33)orthorhombic2.640.0000-9.8364.41
Pna21 (No. 33)
P21 (No. 4)Monoclinic5.11
P-421m (No. 113)Tetragonal5.11
P21 (No. 4)Monoclinic5.13
Uses

Applications

Where MgGeN2 is used.

Semiconductor researchOptoelectronic material development
Reference

Frequently Asked Questions

Common questions about MgGeN2, answered from cross-validated data.

What is MgGeN2?

MgGeN2 is a thermodynamically stable semiconducting nitride compound.

More questions
What is MgGeN2 used for?
MgGeN2 is used in semiconductor research and optoelectronic material development.
What is the band gap of MgGeN2?
MgGeN2 has a DFT-computed band gap of 2.64 eV across 5 reported structures.
Is MgGeN2 a metal, semiconductor, or insulator?
With a band gap up to 2.64 eV it is a semiconductor.
Is MgGeN2 thermodynamically stable?
Yes — MgGeN2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of MgGeN2?
The lowest-energy reported polymorph of MgGeN2 is orthorhombic symmetry, space group Pna21 (No. 33).
What is the density of MgGeN2?
The computed density of the ground-state structure of MgGeN2 is 4.41 g/cm³.
How many polymorphs of MgGeN2 are known?
5 structures of MgGeN2 are reported across 3 databases, spanning 3 distinct space groups.
What elements does MgGeN2 contain?
MgGeN2 contains Ge, Mg, and N (3 elements).
Where does the data for MgGeN2 come from?
MgGeN2 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a ternary nitride, MgGeN2 represents a distinct class of materials that bridge the gap between simple binary nitrides and more complex multinary systems, offering a stable platform for exploring tunable electronic properties.

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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