CoIrLa2

CoIrLa2 is a semiconducting ternary alloy composed of cobalt, iridium, and lanthanum that is primarily studied for its structural and electronic properties.

Crystal structure of CoIrLa2 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About CoIrLa2

CoIrLa2 is a complex ternary alloy featuring cobalt, iridium, and lanthanum. As a member of the platinum-group alloy catalyst class, it exhibits semiconducting electronic behavior, making it an intriguing subject for research into specialized catalytic surfaces and electronic materials.

While this compound has been identified across multiple structural databases, its thermodynamic profile indicates it sits above the stability hull. This suggests that while it can be synthesized in specific structural configurations, it remains a metastable phase of significant interest for fundamental materials science studies.

At a glance

Key Properties

Cross-validated computational properties for CoIrLa2, aggregated across 3 databases.

Band Gap

0.21 eV
Range across DFT structures

Energy Above Hull

1.976 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

8
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for CoIrLa2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.211.9758-4.9530.90
I-4m2 (No. 119)
9.63
9.84
10.69
10.69
10.69
10.69
Uses

Applications

Where CoIrLa2 is used.

Catalytic researchFundamental materials scienceElectronic property studies
Reference

Frequently Asked Questions

Common questions about CoIrLa2, answered from cross-validated data.

What is CoIrLa2?

CoIrLa2 is a semiconducting ternary alloy composed of cobalt, iridium, and lanthanum that is primarily studied for its structural and electronic properties.

More questions
What is CoIrLa2 used for?
CoIrLa2 is used in catalytic research, fundamental materials science, and electronic property studies.
What is the band gap of CoIrLa2?
CoIrLa2 has a DFT-computed band gap of 0.21 eV across 8 reported structures.
Is CoIrLa2 a metal, semiconductor, or insulator?
With a band gap up to 0.21 eV it is a semiconductor.
Is CoIrLa2 thermodynamically stable?
CoIrLa2 has a lowest energy above hull of 1.976 eV/atom (above hull).
What is the crystal structure of CoIrLa2?
The lowest-energy reported polymorph of CoIrLa2 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of CoIrLa2?
The computed density of the ground-state structure of CoIrLa2 is 0.90 g/cm³.
How many polymorphs of CoIrLa2 are known?
8 structures of CoIrLa2 are reported across 3 databases, spanning 2 distinct space groups.
What elements does CoIrLa2 contain?
CoIrLa2 contains Co, Ir, and La (3 elements).
Where does the data for CoIrLa2 come from?
CoIrLa2 data is cross-referenced from materials_project, nomad, omat24.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Compared to more common or stable platinum-group alloys like LaRh or IrSe2, CoIrLa2 occupies a more precarious thermodynamic position. While many of its class members are characterized by high stability, CoIrLa2 represents a more elusive phase that challenges our understanding of how transition metal and lanthanide combinations influence electronic properties in catalytic systems.

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Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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