Al4I16Tl4

Al4I16Tl4 is a thermodynamically stable, insulating inorganic compound composed of aluminum, iodine, and thallium.

AlITl
Crystal structure of Al4I16Tl4
Ground-state structure · Materials Project
Overview

About Al4I16Tl4

Al4I16Tl4 is a complex inorganic compound characterized by its insulating electronic nature and wide band gap. As a thermodynamically stable phase residing on the convex hull, it represents a well-defined structural arrangement of aluminum, iodine, and thallium atoms.

This material is of interest for fundamental solid-state research due to its distinct chemical composition and stable configuration. Its electronic properties suggest potential utility in specialized optical or dielectric applications where insulating behavior is a primary requirement.

At a glance

Key Properties

Cross-validated computational properties for Al4I16Tl4, aggregated across 3 databases.

Band Gap

3.50 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

3
3 databases, 1 space group
Uses

Applications

Where Al4I16Tl4 is used.

Fundamental solid-state researchDielectric material studiesOptical component development
Reference

Frequently Asked Questions

Common questions about Al4I16Tl4, answered from cross-validated data.

What is Al4I16Tl4?

Al4I16Tl4 is a thermodynamically stable, insulating inorganic compound composed of aluminum, iodine, and thallium.

More questions
What is Al4I16Tl4 used for?
Al4I16Tl4 is used in fundamental solid-state research, dielectric material studies, and optical component development.
What is the band gap of Al4I16Tl4?
Al4I16Tl4 has a DFT-computed band gap of 3.50 eV across 3 reported structures.
Is Al4I16Tl4 a metal, semiconductor, or insulator?
With a wide band gap up to 3.50 eV it is an insulator / wide-band-gap material.
Is Al4I16Tl4 thermodynamically stable?
Yes — Al4I16Tl4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Al4I16Tl4 are known?
3 structures of Al4I16Tl4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Al4I16Tl4 contain?
Al4I16Tl4 contains Al, I, and Tl (3 elements).
Where does the data for Al4I16Tl4 come from?
Al4I16Tl4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique inorganic phase, Al4I16Tl4 occupies a distinct position in materials science, serving as a stable reference point for complex halide-based systems containing both main-group and heavy metal elements.

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

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