Pd2Y1Zn1

Pd2Y1Zn1 is a metastable, semimetallic intermetallic alloy composed of palladium, yttrium, and zinc used in materials science research.

Crystal structure of Pd2Y1Zn1
Ground-state structure · Materials Project
Overview

About Pd2Y1Zn1

Pd2Y1Zn1 is a complex intermetallic compound belonging to the platinum-group alloy class. Characterized by a near-zero-gap electronic structure, it functions as a semimetallic material that bridges the gap between traditional metallic conductors and semiconductors.

As a metastable phase, this compound represents a unique configuration within its structural family. Its composition, which integrates palladium, yttrium, and zinc, makes it a subject of interest for researchers investigating the catalytic potential of multi-elemental transition metal alloys.

At a glance

Key Properties

Cross-validated computational properties for Pd2Y1Zn1, aggregated across 2 databases.

Band Gap

0.01 eV
Range across DFT structures

Energy Above Hull

0.039 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

28
2 databases, 18 space groups
Uses

Applications

Where Pd2Y1Zn1 is used.

Catalysis researchIntermetallic alloy developmentElectronic materials study
Reference

Frequently Asked Questions

Common questions about Pd2Y1Zn1, answered from cross-validated data.

What is Pd2Y1Zn1?

Pd2Y1Zn1 is a metastable, semimetallic intermetallic alloy composed of palladium, yttrium, and zinc used in materials science research.

More questions
What is Pd2Y1Zn1 used for?
Pd2Y1Zn1 is used in catalysis research, intermetallic alloy development, and electronic materials study.
What is the band gap of Pd2Y1Zn1?
Pd2Y1Zn1 has a DFT-computed band gap of 0.01 eV across 28 reported structures.
Is Pd2Y1Zn1 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Pd2Y1Zn1 thermodynamically stable?
Pd2Y1Zn1 has a lowest energy above hull of 0.039 eV/atom (metastable).
How many polymorphs of Pd2Y1Zn1 are known?
28 structures of Pd2Y1Zn1 are reported across 2 databases, spanning 18 distinct space groups.
What elements does Pd2Y1Zn1 contain?
Pd2Y1Zn1 contains Pd, Y, and Zn (3 elements).
Where does the data for Pd2Y1Zn1 come from?
Pd2Y1Zn1 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, Pd2Y1Zn1 occupies a distinct niche compared to more stable, binary counterparts like BaPd or GeRu. While many members of this class are explored for their robust structural integrity, Pd2Y1Zn1 is notable for its metastable nature, providing a different pathway for catalytic activity and electronic tuning than the more conventional phases found in the group.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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

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