TlCl2

TlCl2 is a thermodynamically stable, semiconducting inorganic compound composed of thallium and chlorine.

ClTl
Crystal structure of TlCl2
Ground-state structure · Materials Project
Overview

About TlCl2

TlCl2 is a binary inorganic compound composed of thallium and chlorine. As a thermodynamically stable phase located on the convex hull, it represents a well-defined structural configuration within its chemical system.

This material exhibits semiconducting electronic properties, making it an object of interest for fundamental studies in solid-state physics. Its structural diversity is highlighted by numerous reported configurations across major materials databases.

At a glance

Key Properties

Cross-validated computational properties for TlCl2, aggregated across 3 databases.

Band Gap

2.25 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

45
3 databases, 8 space groups
Uses

Applications

Where TlCl2 is used.

Solid-state physics researchMaterials science characterization
Reference

Frequently Asked Questions

Common questions about TlCl2, answered from cross-validated data.

What is TlCl2?

TlCl2 is a thermodynamically stable, semiconducting inorganic compound composed of thallium and chlorine.

More questions
What is TlCl2 used for?
TlCl2 is used in solid-state physics research and materials science characterization.
What is the band gap of TlCl2?
TlCl2 has a DFT-computed band gap of 2.25 eV across 45 reported structures.
Is TlCl2 a metal, semiconductor, or insulator?
With a band gap up to 2.25 eV it is a semiconductor.
Is TlCl2 thermodynamically stable?
Yes — TlCl2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of TlCl2 are known?
45 structures of TlCl2 are reported across 3 databases, spanning 8 distinct space groups.
What elements does TlCl2 contain?
TlCl2 contains Cl and Tl (2 elements).
Where does the data for TlCl2 come from?
TlCl2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct inorganic phase, TlCl2 serves as a foundational reference point for thallium-based halide systems, representing a stable stoichiometry that provides insight into the bonding and structural preferences of heavy metal halides.

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

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