Hf1Os2Zr1

Hf1Os2Zr1 is a thermodynamically stable, semiconducting intermetallic compound composed of hafnium, osmium, and zirconium.

HfOsZr
Crystal structure of Hf1Os2Zr1
Ground-state structure · Materials Project
Overview

About Hf1Os2Zr1

Hf1Os2Zr1 is a complex intermetallic compound composed of hafnium, osmium, and zirconium. As a thermodynamically stable phase residing on the convex hull, it represents a robust structural arrangement of these transition metals, offering a reliable platform for studying multi-component electronic systems.

This material exhibits semiconducting electronic character, distinguishing it from purely metallic alloys. Its structural diversity is highlighted by numerous reported configurations, making it a subject of interest for researchers investigating the interplay between heavy transition metals in solid-state chemistry.

At a glance

Key Properties

Cross-validated computational properties for Hf1Os2Zr1, aggregated across 2 databases.

Band Gap

0.13 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
1 DFT source

Structures

28
2 databases, 16 space groups
Uses

Applications

Where Hf1Os2Zr1 is used.

Solid-state researchFundamental materials scienceElectronic property studies
Reference

Frequently Asked Questions

Common questions about Hf1Os2Zr1, answered from cross-validated data.

What is Hf1Os2Zr1?

Hf1Os2Zr1 is a thermodynamically stable, semiconducting intermetallic compound composed of hafnium, osmium, and zirconium.

More questions
What is Hf1Os2Zr1 used for?
Hf1Os2Zr1 is used in solid-state research, fundamental materials science, and electronic property studies.
What is the band gap of Hf1Os2Zr1?
Hf1Os2Zr1 has a DFT-computed band gap of 0.13 eV across 28 reported structures.
Is Hf1Os2Zr1 a metal, semiconductor, or insulator?
With a band gap up to 0.13 eV it is a semiconductor.
Is Hf1Os2Zr1 thermodynamically stable?
Yes — Hf1Os2Zr1 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Hf1Os2Zr1 are known?
28 structures of Hf1Os2Zr1 are reported across 2 databases, spanning 16 distinct space groups.
What elements does Hf1Os2Zr1 contain?
Hf1Os2Zr1 contains Hf, Os, and Zr (3 elements).
Where does the data for Hf1Os2Zr1 come from?
Hf1Os2Zr1 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique ternary intermetallic, Hf1Os2Zr1 occupies a distinct position in materials science, serving as a foundational example of how heavy transition metals can be combined to achieve thermodynamic stability while maintaining semiconducting properties.

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

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