LaBr2

LaBr2 is a semiconducting lanthanum bromide compound that is considered a viable candidate for experimental synthesis.

BrLa
Crystal structure of LaBr2
Ground-state structure · Materials Project
Overview

About LaBr2

LaBr2 is a binary inorganic compound composed of lanthanum and bromine. It exhibits semiconducting electronic properties, positioning it as a material of interest for specialized electronic or optoelectronic applications where specific charge carrier behaviors are required. The compound is categorized as near-hull, indicating that it is thermodynamically stable enough to be considered a viable target for experimental synthesis.

With a significant number of reported structures across multiple databases, LaBr2 has garnered attention as a subject for computational and structural exploration. Its ability to maintain structural integrity under various conditions makes it a noteworthy entry in the study of lanthanide halides, particularly for researchers investigating the intersection of rare-earth chemistry and semiconductor physics.

At a glance

Key Properties

Cross-validated computational properties for LaBr2, aggregated across 3 databases.

Band Gap

0.59 eV
Range across DFT structures

Energy Above Hull

0.003 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

22
3 databases, 8 space groups
Uses

Applications

Where LaBr2 is used.

Semiconductor researchSolid-state chemistryMaterials science exploration
Reference

Frequently Asked Questions

Common questions about LaBr2, answered from cross-validated data.

What is LaBr2?

LaBr2 is a semiconducting lanthanum bromide compound that is considered a viable candidate for experimental synthesis.

More questions
What is LaBr2 used for?
LaBr2 is used in semiconductor research, solid-state chemistry, and materials science exploration.
What is the band gap of LaBr2?
LaBr2 has a DFT-computed band gap of 0.59 eV across 22 reported structures.
Is LaBr2 a metal, semiconductor, or insulator?
With a band gap up to 0.59 eV it is a semiconductor.
Is LaBr2 thermodynamically stable?
LaBr2 has a lowest energy above hull of 0.003 eV/atom (near hull (likely stable)).
How many polymorphs of LaBr2 are known?
22 structures of LaBr2 are reported across 3 databases, spanning 8 distinct space groups.
What elements does LaBr2 contain?
LaBr2 contains Br and La (2 elements).
Where does the data for LaBr2 come from?
LaBr2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct lanthanum halide, LaBr2 serves as a unique case study within the broader family of rare-earth bromides. While many halides in this class are known for their insulating properties, the semiconducting nature of this specific stoichiometry provides a different electronic profile, making it a valuable reference point for understanding how lanthanum-bromine coordination influences charge transport properties.

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

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