Cl4Hg12I4S8

Cl4Hg12I4S8 is a complex semiconducting quaternary compound containing mercury, sulfur, chlorine, and iodine that is potentially synthesizable.

ClHgIS
Crystal structure of Cl4Hg12I4S8
Ground-state structure · Materials Project
Overview

About Cl4Hg12I4S8

Cl4Hg12I4S8 is a complex quaternary inorganic compound composed of mercury, chlorine, iodine, and sulfur. It exhibits semiconducting electronic properties, positioning it as a material of interest for specialized electronic or optoelectronic applications.

As a near-hull phase, this compound is considered thermodynamically stable enough to be a viable target for experimental synthesis. Its structural complexity is highlighted by multiple reported configurations across materials databases, suggesting a rich landscape for further investigation into its physical properties.

At a glance

Key Properties

Cross-validated computational properties for Cl4Hg12I4S8, aggregated across 3 databases.

Band Gap

1.40 eV
Range across DFT structures

Energy Above Hull

0.014 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where Cl4Hg12I4S8 is used.

Semiconductor researchSolid-state chemistry studiesMaterials science exploration
Reference

Frequently Asked Questions

Common questions about Cl4Hg12I4S8, answered from cross-validated data.

What is Cl4Hg12I4S8?

Cl4Hg12I4S8 is a complex semiconducting quaternary compound containing mercury, sulfur, chlorine, and iodine that is potentially synthesizable.

More questions
What is Cl4Hg12I4S8 used for?
Cl4Hg12I4S8 is used in semiconductor research, solid-state chemistry studies, and materials science exploration.
What is the band gap of Cl4Hg12I4S8?
Cl4Hg12I4S8 has a DFT-computed band gap of 1.40 eV across 5 reported structures.
Is Cl4Hg12I4S8 a metal, semiconductor, or insulator?
With a band gap up to 1.40 eV it is a semiconductor.
Is Cl4Hg12I4S8 thermodynamically stable?
Cl4Hg12I4S8 has a lowest energy above hull of 0.014 eV/atom (near hull (likely stable)).
How many polymorphs of Cl4Hg12I4S8 are known?
5 structures of Cl4Hg12I4S8 are reported across 3 databases, spanning 1 distinct space group.
What elements does Cl4Hg12I4S8 contain?
Cl4Hg12I4S8 contains Cl, Hg, I, and S (4 elements).
Where does the data for Cl4Hg12I4S8 come from?
Cl4Hg12I4S8 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique quaternary mercury-based system, Cl4Hg12I4S8 occupies a specialized niche in materials science. Unlike simpler binary or ternary chalcogenides, this compound integrates multiple halides and sulfur into a single framework, offering a distinct structural complexity that differentiates it from more conventional semiconductor materials.

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

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