Ga1Pd1Sc2

Ga1Pd1Sc2 is a semiconducting ternary intermetallic alloy composed of gallium, palladium, and scandium that is of interest for catalytic applications.

Crystal structure of Ga1Pd1Sc2
Ground-state structure · Materials Project
Overview

About Ga1Pd1Sc2

Ga1Pd1Sc2 is a specialized ternary intermetallic compound categorized within the platinum-group alloy catalysts. Its electronic structure exhibits semiconducting behavior, which distinguishes it from the metallic nature often found in similar transition metal alloys. The material is characterized as near-hull, indicating it is thermodynamically stable enough to be considered a viable target for experimental synthesis and structural analysis.

This compound represents a complex structural arrangement within its class, supported by a significant body of reported structural data. Its unique combination of gallium, palladium, and scandium suggests potential utility in catalytic processes where specific electronic environments are required to facilitate chemical transformations.

At a glance

Key Properties

Cross-validated computational properties for Ga1Pd1Sc2, aggregated across 2 databases.

Band Gap

0.21 eV
Range across DFT structures

Energy Above Hull

0.020 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
1 DFT source

Structures

27
2 databases, 15 space groups
Uses

Applications

Where Ga1Pd1Sc2 is used.

Catalysis researchIntermetallic materials developmentElectronic property studies
Reference

Frequently Asked Questions

Common questions about Ga1Pd1Sc2, answered from cross-validated data.

What is Ga1Pd1Sc2?

Ga1Pd1Sc2 is a semiconducting ternary intermetallic alloy composed of gallium, palladium, and scandium that is of interest for catalytic applications.

More questions
What is Ga1Pd1Sc2 used for?
Ga1Pd1Sc2 is used in catalysis research, intermetallic materials development, and electronic property studies.
What is the band gap of Ga1Pd1Sc2?
Ga1Pd1Sc2 has a DFT-computed band gap of 0.21 eV across 27 reported structures.
Is Ga1Pd1Sc2 a metal, semiconductor, or insulator?
With a band gap up to 0.21 eV it is a semiconductor.
Is Ga1Pd1Sc2 thermodynamically stable?
Ga1Pd1Sc2 has a lowest energy above hull of 0.020 eV/atom (near hull (likely stable)).
How many polymorphs of Ga1Pd1Sc2 are known?
27 structures of Ga1Pd1Sc2 are reported across 2 databases, spanning 15 distinct space groups.
What elements does Ga1Pd1Sc2 contain?
Ga1Pd1Sc2 contains Ga, Pd, and Sc (3 elements).
Where does the data for Ga1Pd1Sc2 come from?
Ga1Pd1Sc2 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse family of platinum-group alloys, Ga1Pd1Sc2 occupies a distinct niche compared to simpler binary systems like BaPd or LaRh. While many members of this class exhibit metallic conductivity, the semiconducting nature of this ternary phase provides a different electronic landscape for surface-mediated reactions, setting it apart from the more traditional metallic behavior observed in compounds such as GeRu or Ga2Ru.

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Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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

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