CdSO3

cadmium sulfite

Cadmium sulfite is a metastable, wide-band-gap insulating compound that is part of the transparent conducting oxide material class.

Crystal structure of CdSO3 (monoclinic, P21/c (No. 14))
Ground-state structure · Materials Project
Overview

About cadmium sulfite

Cadmium sulfite is a metastable inorganic compound that falls within the broader category of transparent conducting oxides. Its electronic character is defined by a wide band gap, which renders it an insulating material under standard conditions. This electronic profile makes it a subject of interest for researchers investigating the fundamental limits of transparency and conductivity in metal-sulfite systems.

Despite its metastability, the compound exhibits significant structural diversity, with multiple reported configurations across various databases. This structural richness highlights the complex nature of cadmium-based oxo-anion materials and provides a foundation for understanding how atomic arrangements influence the physical properties of wide-gap insulators.

At a glance

Key Properties

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

Band Gap

3.04–3.33 eV
Range across DFT structures

Energy Above Hull

0.096 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

12
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for CdSO3, 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)monoclinic3.220.0962-5.6204.09
P21/c (No. 14)monoclinic3.330.0963-5.6204.25
R-3 (No. 148)trigonal3.040.0991-5.6184.24
P21/c (No. 14)Monoclinic4.25
P21/c (No. 14)Monoclinic4.53
P21/c (No. 14)Monoclinic4.34
P21/c (No. 14)
R-3 (No. 148)Trigonal4.24
R-3 (No. 148)Trigonal4.34
P21/c (No. 14)
P21/c (No. 14)
R-3 (No. 148)Trigonal4.53
Uses

Applications

Where cadmium sulfite is used.

Fundamental materials researchSolid-state chemistry studiesStructural analysis of metal sulfites
Reference

Frequently Asked Questions

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

What is CdSO3?

Cadmium sulfite is a metastable, wide-band-gap insulating compound that is part of the transparent conducting oxide material class.

More questions
What is CdSO3 used for?
cadmium sulfite (CdSO3) is used in fundamental materials research, solid-state chemistry studies, and structural analysis of metal sulfites.
What is the band gap of CdSO3?
cadmium sulfite (CdSO3) has a DFT-computed band gap of 3.04–3.33 eV across 12 reported structures.
Is CdSO3 a metal, semiconductor, or insulator?
With a wide band gap up to 3.33 eV it is an insulator / wide-band-gap material.
Is CdSO3 thermodynamically stable?
cadmium sulfite (CdSO3) has a lowest energy above hull of 0.096 eV/atom (metastable).
What is the crystal structure of CdSO3?
The lowest-energy reported polymorph of cadmium sulfite (CdSO3) is monoclinic symmetry, space group P21/c (No. 14).
What is the density of CdSO3?
The computed density of the ground-state structure of cadmium sulfite (CdSO3) is 4.09 g/cm³.
How many polymorphs of CdSO3 are known?
12 structures of CdSO3 are reported across 3 databases, spanning 2 distinct space groups.
What elements does CdSO3 contain?
cadmium sulfite (CdSO3) contains Cd, O, and S (3 elements).
Where does the data for CdSO3 come from?
CdSO3 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the transparent conducting oxides class.

Within the class of transparent conducting oxides, cadmium sulfite occupies a distinct niche compared to more industrially prevalent members like ZnO or BaSnO3. While materials such as ZnO are celebrated for their robust conductivity and stability, cadmium sulfite is characterized by its metastable nature and insulating behavior, serving as a specialized study in the structural variations possible within this oxide-based family.

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Related Compounds

Other Transparent Conducting Oxides in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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