CuIrMg2

CuIrMg2 is a semimetallic, metastable intermetallic alloy composed of copper, iridium, and magnesium, primarily studied for its potential role in catalytic applications.

Crystal structure of CuIrMg2
Ground-state structure · Materials Project
Overview

About CuIrMg2

CuIrMg2 is a complex intermetallic compound categorized within the platinum-group alloy catalyst family. Characterized by its near-zero-gap semimetallic electronic structure, this material represents a unique intersection of transition metals and alkaline earth elements, offering distinct pathways for catalytic surface interactions.

Despite its existence in multiple structural databases, the compound is identified as being thermodynamically unstable relative to its constituent elements. This metastable nature is a critical factor for researchers investigating phase stability and the potential for synthesizing novel catalytic architectures in high-energy environments.

At a glance

Key Properties

Cross-validated computational properties for CuIrMg2, aggregated across 3 databases.

Band Gap

0.06 eV
Range across DFT structures

Energy Above Hull

2.282 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where CuIrMg2 is used.

Catalysis researchIntermetallic phase stability studiesMaterials science fundamental research
Reference

Frequently Asked Questions

Common questions about CuIrMg2, answered from cross-validated data.

What is CuIrMg2?

CuIrMg2 is a semimetallic, metastable intermetallic alloy composed of copper, iridium, and magnesium, primarily studied for its potential role in catalytic applications.

More questions
What is CuIrMg2 used for?
CuIrMg2 is used in catalysis research, intermetallic phase stability studies, and materials science fundamental research.
What is the band gap of CuIrMg2?
CuIrMg2 has a DFT-computed band gap of 0.06 eV across 5 reported structures.
Is CuIrMg2 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is CuIrMg2 thermodynamically stable?
CuIrMg2 has a lowest energy above hull of 2.282 eV/atom (above hull).
How many polymorphs of CuIrMg2 are known?
5 structures of CuIrMg2 are reported across 3 databases, spanning 1 distinct space group.
What elements does CuIrMg2 contain?
CuIrMg2 contains Cu, Ir, and Mg (3 elements).
Where does the data for CuIrMg2 come from?
CuIrMg2 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse landscape of platinum-group alloys, CuIrMg2 occupies a niche position compared to more stable or common phases like As2Ir or Ga2Ru. While many members of this class are explored for their robust structural integrity, this compound stands out due to its position above the thermodynamic hull, suggesting that its utility is likely tied to non-equilibrium synthesis methods rather than traditional bulk processing.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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

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