IrRhZn2

IrRhZn2 is a semiconducting ternary alloy of iridium, rhodium, and zinc investigated for its potential catalytic properties.

Crystal structure of IrRhZn2
Ground-state structure · Materials Project
Overview

About IrRhZn2

IrRhZn2 is a complex ternary alloy composed of iridium, rhodium, and zinc. As a member of the platinum-group alloy catalyst family, it exhibits semiconducting electronic properties that distinguish it from the more metallic members of its class. Its structural complexity is highlighted by its multiple reported configurations across various databases.

While the compound is currently characterized as being above the thermodynamic hull, its existence in multiple structural forms suggests significant interest in its potential catalytic behavior. Research into such metastable phases is vital for understanding how specific atomic arrangements can be stabilized to unlock unique surface reactivity for chemical transformations.

At a glance

Key Properties

Cross-validated computational properties for IrRhZn2, aggregated across 4 databases.

Band Gap

0.15 eV
Range across DFT structures

Energy Above Hull

2.711 eV/atom
Best (lowest) across sources

Stability

Above hull
3 DFT sources

Structures

7
4 databases, 2 space groups
Uses

Applications

Where IrRhZn2 is used.

Catalytic researchMaterials science explorationSurface reactivity studies
Reference

Frequently Asked Questions

Common questions about IrRhZn2, answered from cross-validated data.

What is IrRhZn2?

IrRhZn2 is a semiconducting ternary alloy of iridium, rhodium, and zinc investigated for its potential catalytic properties.

More questions
What is IrRhZn2 used for?
IrRhZn2 is used in catalytic research, materials science exploration, and surface reactivity studies.
What is the band gap of IrRhZn2?
IrRhZn2 has a DFT-computed band gap of 0.15 eV across 7 reported structures.
Is IrRhZn2 a metal, semiconductor, or insulator?
With a band gap up to 0.15 eV it is a semiconductor.
Is IrRhZn2 thermodynamically stable?
IrRhZn2 has a lowest energy above hull of 2.711 eV/atom (above hull).
How many polymorphs of IrRhZn2 are known?
7 structures of IrRhZn2 are reported across 4 databases, spanning 2 distinct space groups.
What elements does IrRhZn2 contain?
IrRhZn2 contains Ir, Rh, and Zn (3 elements).
Where does the data for IrRhZn2 come from?
IrRhZn2 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Unlike the more common metallic phases found in the platinum-group alloy class, such as LaRh or BaPd, IrRhZn2 occupies a distinct niche due to its semiconducting nature. While many siblings like As2Ir or As2Pt are studied for their robust stability, IrRhZn2 represents a more unconventional, metastable member that challenges standard design principles for high-performance catalysts.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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

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