Br32Hg24Te8

Br32Hg24Te8 is a thermodynamically stable semiconducting material composed of bromine, mercury, and tellurium.

BrHgTe
Crystal structure of Br32Hg24Te8 (orthorhombic, Pbca (No. 61))
Ground-state structure · Materials Project
Overview

About Br32Hg24Te8

Br32Hg24Te8 is a complex inorganic compound composed of bromine, mercury, and tellurium. As a thermodynamically stable phase located on the convex hull, it represents a robust structural arrangement within its chemical system.

This material exhibits semiconducting electronic characteristics, making it an interesting candidate for specialized electronic and optoelectronic applications. Its structural integrity and distinct elemental composition contribute to its role in the study of chalcogenide-halide materials.

At a glance

Key Properties

Cross-validated computational properties for Br32Hg24Te8, aggregated across 3 databases.

Band Gap

2.05 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
Crystallography

Reported Structures

Lowest-energy structures reported for Br32Hg24Te8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pbca (No. 61)orthorhombic2.050.0000-2.0676.03
Pbca (No. 61)
5.62
Uses

Applications

Where Br32Hg24Te8 is used.

Semiconductor researchMaterials science studiesSolid-state chemistry
Reference

Frequently Asked Questions

Common questions about Br32Hg24Te8, answered from cross-validated data.

What is Br32Hg24Te8?

Br32Hg24Te8 is a thermodynamically stable semiconducting material composed of bromine, mercury, and tellurium.

More questions
What is Br32Hg24Te8 used for?
Br32Hg24Te8 is used in semiconductor research, materials science studies, and solid-state chemistry.
What is the band gap of Br32Hg24Te8?
Br32Hg24Te8 has a DFT-computed band gap of 2.05 eV across 3 reported structures.
Is Br32Hg24Te8 a metal, semiconductor, or insulator?
With a band gap up to 2.05 eV it is a semiconductor.
Is Br32Hg24Te8 thermodynamically stable?
Yes — Br32Hg24Te8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Br32Hg24Te8?
The lowest-energy reported polymorph of Br32Hg24Te8 is orthorhombic symmetry, space group Pbca (No. 61).
What is the density of Br32Hg24Te8?
The computed density of the ground-state structure of Br32Hg24Te8 is 6.03 g/cm³.
How many polymorphs of Br32Hg24Te8 are known?
3 structures of Br32Hg24Te8 are reported across 3 databases, spanning 1 distinct space group.
What elements does Br32Hg24Te8 contain?
Br32Hg24Te8 contains Br, Hg, and Te (3 elements).
Where does the data for Br32Hg24Te8 come from?
Br32Hg24Te8 data is cross-referenced from materials_project, aflow, omat24.
Comparison

How It Compares

As a unique member of the mercury-tellurium-bromide family, this compound serves as a critical reference point for understanding phase stability and electronic behavior in multi-component halide-chalcogenide systems.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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