TlHO

TlHO is a metastable semiconducting compound consisting of thallium, hydrogen, and oxygen atoms.

HOTl
Crystal structure of TlHO
Ground-state structure · Materials Project
Overview

About TlHO

TlHO is a semiconducting compound composed of thallium, hydrogen, and oxygen. As a metastable material, it represents a unique chemical configuration that is the subject of ongoing structural investigation across multiple databases. Its electronic character suggests potential utility in specialized semiconductor research where specific band structures are required. Because it exists in a metastable state, it offers researchers a distinct opportunity to study phase transitions and synthesis pathways that are not accessible in more stable, naturally occurring oxides. This compound serves as a valuable case study for understanding the complex bonding behavior of heavy metal hydroxides in solid-state chemistry.

At a glance

Key Properties

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

Band Gap

1.52 eV
Range across DFT structures

Energy Above Hull

0.033 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

11
3 databases, 7 space groups
Uses

Applications

Where TlHO is used.

Semiconductor researchSolid-state chemistry studiesFundamental materials characterization
Reference

Frequently Asked Questions

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

What is TlHO?

TlHO is a metastable semiconducting compound consisting of thallium, hydrogen, and oxygen atoms.

More questions
What is TlHO used for?
TlHO is used in semiconductor research, solid-state chemistry studies, and fundamental materials characterization.
What is the band gap of TlHO?
TlHO has a DFT-computed band gap of 1.52 eV across 11 reported structures.
Is TlHO a metal, semiconductor, or insulator?
With a band gap up to 1.52 eV it is a semiconductor.
Is TlHO thermodynamically stable?
TlHO has a lowest energy above hull of 0.033 eV/atom (metastable).
How many polymorphs of TlHO are known?
11 structures of TlHO are reported across 3 databases, spanning 7 distinct space groups.
What elements does TlHO contain?
TlHO contains H, O, and Tl (3 elements).
Where does the data for TlHO come from?
TlHO data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique inorganic compound, TlHO occupies a specialized niche in materials science. Without direct structural siblings in its immediate class, it serves as a primary reference point for investigating the interplay between heavy thallium cations and hydroxyl groups in a semiconducting framework.

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

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