Cl4I4Pb4

Cl4I4Pb4 is a metastable, semiconducting lead-halide compound used primarily in foundational materials research.

ClIPb
Crystal structure of Cl4I4Pb4
Ground-state structure · Materials Project
Overview

About Cl4I4Pb4

Cl4I4Pb4 is a complex lead-based halide material characterized by its semiconducting electronic nature. As a metastable compound, it represents a unique structural configuration within the broader family of lead-halide materials, offering researchers a distinct platform for studying phase transitions and stability in inorganic solid-state chemistry.

Its existence across multiple structural databases highlights its significance as a subject of ongoing crystallographic investigation. By balancing lead, chlorine, and iodine, this compound serves as an intriguing model for understanding how halide substitution influences the electronic properties of heavy-metal frameworks.

At a glance

Key Properties

Cross-validated computational properties for Cl4I4Pb4, aggregated across 3 databases.

Band Gap

2.72 eV
Range across DFT structures

Energy Above Hull

0.068 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

7
3 databases, 3 space groups
Uses

Applications

Where Cl4I4Pb4 is used.

Solid-state materials researchCrystallographic studiesSemiconductor development
Reference

Frequently Asked Questions

Common questions about Cl4I4Pb4, answered from cross-validated data.

What is Cl4I4Pb4?

Cl4I4Pb4 is a metastable, semiconducting lead-halide compound used primarily in foundational materials research.

More questions
What is Cl4I4Pb4 used for?
Cl4I4Pb4 is used in solid-state materials research, crystallographic studies, and semiconductor development.
What is the band gap of Cl4I4Pb4?
Cl4I4Pb4 has a DFT-computed band gap of 2.72 eV across 7 reported structures.
Is Cl4I4Pb4 a metal, semiconductor, or insulator?
With a band gap up to 2.72 eV it is a semiconductor.
Is Cl4I4Pb4 thermodynamically stable?
Cl4I4Pb4 has a lowest energy above hull of 0.068 eV/atom (metastable).
How many polymorphs of Cl4I4Pb4 are known?
7 structures of Cl4I4Pb4 are reported across 3 databases, spanning 3 distinct space groups.
What elements does Cl4I4Pb4 contain?
Cl4I4Pb4 contains Cl, I, and Pb (3 elements).
Where does the data for Cl4I4Pb4 come from?
Cl4I4Pb4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique lead-halide assembly, Cl4I4Pb4 occupies a specialized niche in materials science. Unlike more common, highly stable lead-halide perovskites, this compound demonstrates a metastable character that invites further exploration into its synthesis pathways and potential for tunable electronic behavior.

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

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