BaSO3

barium sulfite · barium sulphite

Barium sulfite is a metastable, insulating chemical compound composed of barium, sulfur, and oxygen.

BaOS
Crystal structure of BaSO3
Ground-state structure · Materials Project
Overview

About barium sulfite

Barium sulfite is a chemical compound characterized by its wide-gap insulating electronic structure. As an inorganic salt, it represents a specific arrangement of barium, sulfur, and oxygen atoms that exhibits a metastable thermodynamic profile under ambient conditions.

Because of its distinct electronic nature, this material is of interest for fundamental studies in solid-state chemistry. Its structural diversity is highlighted by the multiple reported configurations found in research databases, reflecting its complex potential for phase behavior.

At a glance

Key Properties

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

Band Gap

4.43 eV
Range across DFT structures

Energy Above Hull

0.069 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

9
4 databases, 3 space groups
Uses

Applications

Where barium sulfite is used.

analytical chemistry reagentspaper manufacturing additivespigment production
Reference

Frequently Asked Questions

Common questions about barium sulfite, answered from cross-validated data.

What is BaSO3?

Barium sulfite is a metastable, insulating chemical compound composed of barium, sulfur, and oxygen.

More questions
What is BaSO3 used for?
barium sulfite (BaSO3) is used in analytical chemistry reagents, paper manufacturing additives, and pigment production.
What is the band gap of BaSO3?
barium sulfite (BaSO3) has a DFT-computed band gap of 4.43 eV across 9 reported structures.
Is BaSO3 a metal, semiconductor, or insulator?
With a wide band gap up to 4.43 eV it is an insulator / wide-band-gap material.
Is BaSO3 thermodynamically stable?
barium sulfite (BaSO3) has a lowest energy above hull of 0.069 eV/atom (metastable).
How many polymorphs of BaSO3 are known?
9 structures of BaSO3 are reported across 4 databases, spanning 3 distinct space groups.
What elements does BaSO3 contain?
barium sulfite (BaSO3) contains Ba, O, and S (3 elements).
Where does the data for BaSO3 come from?
BaSO3 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a standalone representative of its chemical class in this context, barium sulfite serves as a primary reference point for understanding the stability and electronic properties of alkaline earth metal sulfites.

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

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