Ag1Ca2Pd1

Ag1Ca2Pd1 is a metastable, semimetallic intermetallic alloy composed of silver, calcium, and palladium used in materials science research.

Crystal structure of Ag1Ca2Pd1
Ground-state structure · Materials Project
Overview

About Ag1Ca2Pd1

Ag1Ca2Pd1 is a complex intermetallic compound classified within the platinum-group alloy family. It exhibits a semimetallic electronic character, placing it in a distinct regime between traditional conductors and insulators, which influences its potential for specialized catalytic surface interactions. As a metastable phase, this material represents a unique structural configuration that requires precise synthesis conditions. Its existence within a broad range of reported structural variations highlights its significance in fundamental materials research for developing advanced metallic catalysts.

At a glance

Key Properties

Cross-validated computational properties for Ag1Ca2Pd1, aggregated across 2 databases.

Band Gap

0.01 eV
Range across DFT structures

Energy Above Hull

0.034 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

28
2 databases, 16 space groups
Uses

Applications

Where Ag1Ca2Pd1 is used.

Catalysis researchIntermetallic materials developmentFundamental electronic structure studies
Reference

Frequently Asked Questions

Common questions about Ag1Ca2Pd1, answered from cross-validated data.

What is Ag1Ca2Pd1?

Ag1Ca2Pd1 is a metastable, semimetallic intermetallic alloy composed of silver, calcium, and palladium used in materials science research.

More questions
What is Ag1Ca2Pd1 used for?
Ag1Ca2Pd1 is used in catalysis research, intermetallic materials development, and fundamental electronic structure studies.
What is the band gap of Ag1Ca2Pd1?
Ag1Ca2Pd1 has a DFT-computed band gap of 0.01 eV across 28 reported structures.
Is Ag1Ca2Pd1 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Ag1Ca2Pd1 thermodynamically stable?
Ag1Ca2Pd1 has a lowest energy above hull of 0.034 eV/atom (metastable).
How many polymorphs of Ag1Ca2Pd1 are known?
28 structures of Ag1Ca2Pd1 are reported across 2 databases, spanning 16 distinct space groups.
What elements does Ag1Ca2Pd1 contain?
Ag1Ca2Pd1 contains Ag, Ca, and Pd (3 elements).
Where does the data for Ag1Ca2Pd1 come from?
Ag1Ca2Pd1 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse group of platinum-group alloys, Ag1Ca2Pd1 stands out for its specific stoichiometry compared to more conventional binary systems like BaPd or LaRh. While many members of this class are explored for their robust stability, Ag1Ca2Pd1 occupies a more delicate metastable state, offering researchers a different structural pathway for tuning electronic properties compared to the more common transition metal-heavy compounds like GeRu or P3Ru.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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

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