CeN2

Cerium dinitride is a rare-earth metal nitride compound that has been studied for its unique electronic and structural properties. It is primarily utilized in specialized materials science research to investigate the behavior of lanthanide-based nitrides under various conditions.

CeN
Crystal structure of CeN2 (monoclinic, Cm (No. 8))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for CeN2, aggregated across 2 databases.

Band Gap

0.47 eV
Range across DFT structures

Energy Above Hull

0.036 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

58
2 databases, 10 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for CeN2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Cm (No. 8)monoclinic0.470.0365-17.4945.71
C2/m (No. 12)Monoclinic3.99
Cm (No. 8)Monoclinic7.36
P-1 (No. 2)Triclinic6.05
C2/m (No. 12)Monoclinic8.16
C2/m (No. 12)Monoclinic7.26
P-1 (No. 2)Triclinic5.47
C2/m (No. 12)Monoclinic6.21
C2/m (No. 12)Monoclinic5.96
P-1 (No. 2)Triclinic4.60
P-1 (No. 2)Triclinic5.32
Cm (No. 8)Monoclinic7.35
Uses

Applications

Where CeN2 is used.

Materials science researchSolid-state chemistry studies
Reference

Frequently Asked Questions

Common questions about CeN2, answered from cross-validated data.

What is CeN2?

Cerium dinitride is a rare-earth metal nitride compound that has been studied for its unique electronic and structural properties. It is primarily utilized in specialized materials science research to investigate the behavior of lanthanide-based nitrides under various conditions.

More questions
What is CeN2 used for?
CeN2 is used in materials science research and solid-state chemistry studies.
What is the band gap of CeN2?
CeN2 has a DFT-computed band gap of 0.47 eV across 58 reported structures.
Is CeN2 a metal, semiconductor, or insulator?
With a band gap up to 0.47 eV it is a semiconductor.
Is CeN2 thermodynamically stable?
CeN2 has a lowest energy above hull of 0.036 eV/atom (metastable).
What is the crystal structure of CeN2?
The lowest-energy reported polymorph of CeN2 is monoclinic symmetry, space group Cm (No. 8).
What is the density of CeN2?
The computed density of the ground-state structure of CeN2 is 5.71 g/cm³.
How many polymorphs of CeN2 are known?
58 structures of CeN2 are reported across 2 databases, spanning 10 distinct space groups.
What elements does CeN2 contain?
CeN2 contains Ce and N (2 elements).
Where does the data for CeN2 come from?
CeN2 data is cross-referenced from materials_project, mpaloe.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.

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