Cl36S4U4

Cl36S4U4 is a semiconducting, uranium-containing compound that is considered a promising candidate for synthesis due to its favorable thermodynamic stability.

ClSU
Crystal structure of Cl36S4U4 (orthorhombic, P212121 (No. 19))
Ground-state structure · Materials Project
Overview

About Cl36S4U4

Cl36S4U4 is a complex inorganic compound containing chlorine, sulfur, and uranium. Its semiconducting electronic character makes it an intriguing subject for study within advanced materials science, particularly where electronic properties are dictated by heavy actinide elements.

As a near-hull material, this compound occupies a position of relative thermodynamic stability, suggesting it is a viable candidate for experimental synthesis. Its existence within structural databases highlights its potential role in specialized chemical frameworks.

At a glance

Key Properties

Cross-validated computational properties for Cl36S4U4, aggregated across 3 databases.

Band Gap

0.50 eV
Range across DFT structures

Energy Above Hull

0.014 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
1 DFT source

Structures

3
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Cl36S4U4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P212121 (No. 19)orthorhombic0.500.0137-14.1242.70
P212121 (No. 19)
No. 0unknown0.79
Uses

Applications

Where Cl36S4U4 is used.

Fundamental materials researchActinide chemistry studiesSemiconductor development
Reference

Frequently Asked Questions

Common questions about Cl36S4U4, answered from cross-validated data.

What is Cl36S4U4?

Cl36S4U4 is a semiconducting, uranium-containing compound that is considered a promising candidate for synthesis due to its favorable thermodynamic stability.

More questions
What is Cl36S4U4 used for?
Cl36S4U4 is used in fundamental materials research, actinide chemistry studies, and semiconductor development.
What is the band gap of Cl36S4U4?
Cl36S4U4 has a DFT-computed band gap of 0.50 eV across 3 reported structures.
Is Cl36S4U4 a metal, semiconductor, or insulator?
With a band gap up to 0.50 eV it is a semiconductor.
Is Cl36S4U4 thermodynamically stable?
Cl36S4U4 has a lowest energy above hull of 0.014 eV/atom (near hull (likely stable)).
What is the crystal structure of Cl36S4U4?
The lowest-energy reported polymorph of Cl36S4U4 is orthorhombic symmetry, space group P212121 (No. 19).
What is the density of Cl36S4U4?
The computed density of the ground-state structure of Cl36S4U4 is 2.70 g/cm³.
How many polymorphs of Cl36S4U4 are known?
3 structures of Cl36S4U4 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Cl36S4U4 contain?
Cl36S4U4 contains Cl, S, and U (3 elements).
Where does the data for Cl36S4U4 come from?
Cl36S4U4 data is cross-referenced from materials_project, aflow, cod.
Comparison

How It Compares

As a unique inorganic entity, Cl36S4U4 represents a specialized niche in materials science. Without direct structural siblings in this specific class, it serves as a distinct example of how uranium can be integrated into complex halogen-sulfur architectures to achieve semiconducting behavior.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
  • cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).

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