HfSe3

HfSe3 is a semiconducting hafnium selenide compound that is considered a promising candidate for experimental synthesis due to its favorable thermodynamic stability.

HfSe
Crystal structure of HfSe3
Ground-state structure · Materials Project
Overview

About HfSe3

Hafnium triselenide is a semiconducting compound composed of hafnium and selenium. Its electronic character makes it an intriguing candidate for research in thin-film electronics and next-generation device architectures. The material is recognized as being near-hull stable, suggesting it is a viable target for experimental synthesis and structural characterization. With a significant number of reported structures across various databases, it represents a well-documented subject for materials science investigations. Its structural versatility allows for diverse configurations that are essential for understanding its potential in advanced technological applications.

At a glance

Key Properties

Cross-validated computational properties for HfSe3, aggregated across 4 databases.

Band Gap

0.32 eV
Range across DFT structures

Energy Above Hull

0.004 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
3 DFT sources

Structures

98
4 databases, 21 space groups
Uses

Applications

Where HfSe3 is used.

Semiconductor researchOptoelectronic device developmentThin-film electronics
Reference

Frequently Asked Questions

Common questions about HfSe3, answered from cross-validated data.

What is HfSe3?

HfSe3 is a semiconducting hafnium selenide compound that is considered a promising candidate for experimental synthesis due to its favorable thermodynamic stability.

More questions
What is HfSe3 used for?
HfSe3 is used in semiconductor research, optoelectronic device development, and thin-film electronics.
What is the band gap of HfSe3?
HfSe3 has a DFT-computed band gap of 0.32 eV across 98 reported structures.
Is HfSe3 a metal, semiconductor, or insulator?
With a band gap up to 0.32 eV it is a semiconductor.
Is HfSe3 thermodynamically stable?
HfSe3 has a lowest energy above hull of 0.004 eV/atom (near hull (likely stable)).
How many polymorphs of HfSe3 are known?
98 structures of HfSe3 are reported across 4 databases, spanning 21 distinct space groups.
What elements does HfSe3 contain?
HfSe3 contains Hf and Se (2 elements).
Where does the data for HfSe3 come from?
HfSe3 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct member of the hafnium-selenium system, HfSe3 occupies a unique position due to its specific stoichiometry and semiconducting nature. It serves as a fundamental example of how transition metal trichalcogenides can be stabilized, providing a baseline for exploring the electronic properties of similar group four chalcogenides.

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

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