Ag1Pd2Sn1

Ag1Pd2Sn1 is a semiconducting ternary alloy composed of silver, palladium, and tin that is studied for its unique structural and electronic properties.

Crystal structure of Ag1Pd2Sn1 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About Ag1Pd2Sn1

Ag1Pd2Sn1 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 silver, palladium, and tin atoms that has been documented across multiple structural configurations. Its existence as a distinct phase highlights the intricate bonding environments possible within ternary transition metal systems.

While the compound is currently identified as being above the thermodynamic hull, its presence in structural databases underscores the ongoing interest in metastable phases within catalytic research. Understanding such materials is vital for mapping the broader landscape of alloy stability and identifying potential pathways for tailoring electronic properties in advanced catalytic applications.

At a glance

Key Properties

Cross-validated computational properties for Ag1Pd2Sn1, aggregated across 2 databases.

Band Gap

0.81 eV
Range across DFT structures

Energy Above Hull

1.914 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

26
2 databases, 15 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Ag1Pd2Sn1, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.811.9142-21.4810.84
P2/m (No. 10)
Cmmm (No. 65)
I-4m2 (No. 119)
Imm2 (No. 44)
P4mm (No. 99)
Cm (No. 8)
C2/m (No. 12)
P4/mmm (No. 123)
Pmm2 (No. 25)
Fm-3m (No. 225)
Pmmm (No. 47)
Uses

Applications

Where Ag1Pd2Sn1 is used.

Catalytic researchMaterials science studies of metastable phasesElectronic property investigation
Reference

Frequently Asked Questions

Common questions about Ag1Pd2Sn1, answered from cross-validated data.

What is Ag1Pd2Sn1?

Ag1Pd2Sn1 is a semiconducting ternary alloy composed of silver, palladium, and tin that is studied for its unique structural and electronic properties.

More questions
What is Ag1Pd2Sn1 used for?
Ag1Pd2Sn1 is used in catalytic research, materials science studies of metastable phases, and electronic property investigation.
What is the band gap of Ag1Pd2Sn1?
Ag1Pd2Sn1 has a DFT-computed band gap of 0.81 eV across 26 reported structures.
Is Ag1Pd2Sn1 a metal, semiconductor, or insulator?
With a band gap up to 0.81 eV it is a semiconductor.
Is Ag1Pd2Sn1 thermodynamically stable?
Ag1Pd2Sn1 has a lowest energy above hull of 1.914 eV/atom (above hull).
What is the crystal structure of Ag1Pd2Sn1?
The lowest-energy reported polymorph of Ag1Pd2Sn1 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Ag1Pd2Sn1?
The computed density of the ground-state structure of Ag1Pd2Sn1 is 0.84 g/cm³.
How many polymorphs of Ag1Pd2Sn1 are known?
26 structures of Ag1Pd2Sn1 are reported across 2 databases, spanning 15 distinct space groups.
What elements does Ag1Pd2Sn1 contain?
Ag1Pd2Sn1 contains Ag, Pd, and Sn (3 elements).
Where does the data for Ag1Pd2Sn1 come from?
Ag1Pd2Sn1 data is cross-referenced from materials_project, aflow.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse family of platinum-group alloys, Ag1Pd2Sn1 occupies a distinct niche compared to more stable or common binary phases like BaPd or GeRu. While many members of this class are investigated for their robust metallic behavior, Ag1Pd2Sn1 is notable for its semiconducting character, which sets it apart from the typical high-conductivity profiles found in other palladium-based intermetallics.

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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).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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