Al2OsPd

Al2OsPd is a semiconducting intermetallic compound composed of aluminum, osmium, and palladium that is studied for its unique structural and electronic properties.

Crystal structure of Al2OsPd (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About Al2OsPd

Al2OsPd is a specialized intermetallic compound categorized within the platinum-group alloy catalysts. Characterized by its semiconducting electronic nature, this material represents a complex arrangement of aluminum, osmium, and palladium atoms that has been documented across multiple structural databases. Its existence as a distinct phase highlights the intricate bonding behaviors found in transition metal aluminides.

While its thermodynamic profile suggests it resides above the hull, indicating potential instability under standard conditions, the compound remains a subject of interest for researchers studying phase stability and catalytic potential. Its unique composition allows for the exploration of electronic properties that differ significantly from pure noble metals, providing a niche platform for materials science investigations.

At a glance

Key Properties

Cross-validated computational properties for Al2OsPd, aggregated across 3 databases.

Band Gap

0.38–0.57 eV
Range across DFT structures

Energy Above Hull

2.953 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Al2OsPd, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.382.9530-20.1280.52
Immm (No. 71)orthorhombic0.572.9532-20.1280.79
C2/m (No. 12)
Uses

Applications

Where Al2OsPd is used.

Catalysis researchMaterials science explorationIntermetallic phase stability studies
Reference

Frequently Asked Questions

Common questions about Al2OsPd, answered from cross-validated data.

What is Al2OsPd?

Al2OsPd is a semiconducting intermetallic compound composed of aluminum, osmium, and palladium that is studied for its unique structural and electronic properties.

More questions
What is Al2OsPd used for?
Al2OsPd is used in catalysis research, materials science exploration, and intermetallic phase stability studies.
What is the band gap of Al2OsPd?
Al2OsPd has a DFT-computed band gap of 0.38–0.57 eV across 5 reported structures.
Is Al2OsPd a metal, semiconductor, or insulator?
With a band gap up to 0.57 eV it is a semiconductor.
Is Al2OsPd thermodynamically stable?
Al2OsPd has a lowest energy above hull of 2.953 eV/atom (above hull).
What is the crystal structure of Al2OsPd?
The lowest-energy reported polymorph of Al2OsPd is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Al2OsPd?
The computed density of the ground-state structure of Al2OsPd is 0.52 g/cm³.
How many polymorphs of Al2OsPd are known?
5 structures of Al2OsPd are reported across 3 databases, spanning 2 distinct space groups.
What elements does Al2OsPd contain?
Al2OsPd contains Al, Os, and Pd (3 elements).
Where does the data for Al2OsPd come from?
Al2OsPd data is cross-referenced from materials_project, jarvis, alexandria.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse family of platinum-group alloys, Al2OsPd occupies a distinct position compared to more stable or metallic counterparts like P3Ru or BaPd. Unlike the highly conductive or thermodynamically robust members of this class, Al2OsPd exhibits a semiconducting character that sets it apart from the typical metallic behavior expected in many platinum-group systems.

Explore

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).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • alexandria — Data from alexandria.

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