NaNO

NaNO is a metastable, wide-band-gap insulating compound that serves as an important subject for research into the structural diversity of alkali-nitrogen-oxygen systems.

NNaO
Crystal structure of NaNO (monoclinic, P21/c (No. 14))
Ground-state structure · Materials Project
Overview

About NaNO

NaNO is an insulating compound characterized by a wide electronic band gap. As a metastable material, it represents a complex structural system that has been documented across multiple databases, reflecting significant interest in its atomic configuration and potential chemical behavior. Its existence as a metastable phase suggests a delicate balance of internal forces that define its unique electronic landscape. The study of this compound contributes to a broader understanding of how alkali-nitrogen-oxygen systems can be stabilized under specific conditions. By examining its structural diversity, researchers can better map the energetic pathways that govern the formation and stability of such unconventional inorganic materials.

At a glance

Key Properties

Cross-validated computational properties for NaNO, aggregated across 4 databases.

Band Gap

3.39 eV
Range across DFT structures

Energy Above Hull

0.063 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

16
4 databases, 3 space groups
Crystallography

Reported Structures

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

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P21/c (No. 14)monoclinic3.390.0628-5.8382.38
P1 (No. 1)triclinic0.000.7826-5.7891.61
No. 0unknown0.24
No. 0unknown0.23
No. 0unknown0.23
P21/c (No. 14)Monoclinic2.38
No. 0unknown0.23
No. 0unknown0.23
No. 0unknown0.23
No. 0unknown0.85
No. 0unknown0.24
No. 0unknown0.23
Reference

Frequently Asked Questions

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

What is NaNO?

NaNO is a metastable, wide-band-gap insulating compound that serves as an important subject for research into the structural diversity of alkali-nitrogen-oxygen systems.

More questions
What is the band gap of NaNO?
NaNO has a DFT-computed band gap of 3.39 eV across 16 reported structures.
Is NaNO a metal, semiconductor, or insulator?
With a wide band gap up to 3.39 eV it is an insulator / wide-band-gap material.
Is NaNO thermodynamically stable?
NaNO has a lowest energy above hull of 0.063 eV/atom (metastable).
What is the crystal structure of NaNO?
The lowest-energy reported polymorph of NaNO is monoclinic symmetry, space group P21/c (No. 14).
What is the density of NaNO?
The computed density of the ground-state structure of NaNO is 2.38 g/cm³.
How many polymorphs of NaNO are known?
16 structures of NaNO are reported across 4 databases, spanning 3 distinct space groups.
What elements does NaNO contain?
NaNO contains N, Na, and O (3 elements).
Where does the data for NaNO come from?
NaNO data is cross-referenced from materials_project, cod, mpaloe, jarvis.
Comparison

How It Compares

As a unique inorganic material, NaNO functions as an intriguing subject for study within the landscape of metastable nitrogen-containing compounds, where its insulating nature distinguishes it from more conductive or reactive phases found in similar chemical families.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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