H5SeNO3

H5SeNO3 is a metastable, insulating inorganic compound with a wide electronic band gap.

HNOSe
Crystal structure of H5SeNO3
Ground-state structure · Materials Project
Overview

About H5SeNO3

H5SeNO3 is a complex inorganic compound characterized by its insulating electronic nature. As a wide-gap material, it exhibits distinct dielectric properties that are of interest for fundamental studies in solid-state chemistry and materials science.

This material is classified as metastable, indicating that its existence is highly sensitive to environmental conditions and synthesis pathways. Its structural diversity, evidenced by multiple known configurations, suggests a complex energy landscape that researchers continue to investigate to understand its stability and potential functional utility.

At a glance

Key Properties

Cross-validated computational properties for H5SeNO3, aggregated across 3 databases.

Band Gap

4.41 eV
Range across DFT structures

Energy Above Hull

0.093 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

5
3 databases, 2 space groups
Reference

Frequently Asked Questions

Common questions about H5SeNO3, answered from cross-validated data.

What is H5SeNO3?

H5SeNO3 is a metastable, insulating inorganic compound with a wide electronic band gap.

More questions
What is the band gap of H5SeNO3?
H5SeNO3 has a DFT-computed band gap of 4.41 eV across 5 reported structures.
Is H5SeNO3 a metal, semiconductor, or insulator?
With a wide band gap up to 4.41 eV it is an insulator / wide-band-gap material.
Is H5SeNO3 thermodynamically stable?
H5SeNO3 has a lowest energy above hull of 0.093 eV/atom (metastable).
How many polymorphs of H5SeNO3 are known?
5 structures of H5SeNO3 are reported across 3 databases, spanning 2 distinct space groups.
What elements does H5SeNO3 contain?
H5SeNO3 contains H, N, O, and Se (4 elements).
Where does the data for H5SeNO3 come from?
H5SeNO3 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique inorganic species, H5SeNO3 represents a specialized case within the broader landscape of selenium-based compounds, serving as a distinct example of metastable, wide-gap insulating behavior that warrants further structural characterization.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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