LuI3

LuI3 is a thermodynamically stable semiconducting lutetium triiodide used in materials science research.

ILu
Crystal structure of LuI3
Ground-state structure · Materials Project
Overview

About LuI3

Lutetium triiodide is a semiconducting compound characterized by its high thermodynamic stability. As a member of the rare-earth halide family, it occupies a position on the convex hull, indicating a robust structural arrangement that is favorable under standard conditions. Its electronic nature makes it a subject of interest for fundamental studies in solid-state physics.

Researchers value this material for its structural diversity, as evidenced by multiple reported configurations across various databases. Its unique combination of heavy rare-earth cations and halide anions provides a platform for investigating electronic transitions and potential utility in specialized optical or detection technologies.

At a glance

Key Properties

Cross-validated computational properties for LuI3, aggregated across 3 databases.

Band Gap

2.18 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

8
3 databases, 4 space groups
Uses

Applications

Where LuI3 is used.

Solid-state researchOptical materials developmentRadiation detection studies
Reference

Frequently Asked Questions

Common questions about LuI3, answered from cross-validated data.

What is LuI3?

LuI3 is a thermodynamically stable semiconducting lutetium triiodide used in materials science research.

More questions
What is LuI3 used for?
LuI3 is used in solid-state research, optical materials development, and radiation detection studies.
What is the band gap of LuI3?
LuI3 has a DFT-computed band gap of 2.18 eV across 8 reported structures.
Is LuI3 a metal, semiconductor, or insulator?
With a band gap up to 2.18 eV it is a semiconductor.
Is LuI3 thermodynamically stable?
Yes — LuI3 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of LuI3 are known?
8 structures of LuI3 are reported across 3 databases, spanning 4 distinct space groups.
What elements does LuI3 contain?
LuI3 contains I and Lu (2 elements).
Where does the data for LuI3 come from?
LuI3 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a rare-earth halide, LuI3 represents a stable endpoint in the series of lutetium-based halides. While it shares the general chemical framework of its class, its specific electronic character distinguishes it as a semiconducting material suitable for targeted research applications where stability and specific band characteristics are required.

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

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