Ag1Be2Pt1

Ag1Be2Pt1 is a metastable, semiconducting platinum-group alloy used in advanced materials research.

Crystal structure of Ag1Be2Pt1 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About Ag1Be2Pt1

Ag1Be2Pt1 is a member of the platinum-group alloy catalyst class, characterized by its distinct semiconducting electronic nature. Its composition reflects the complex interplay between noble metals and light elements, which often dictates the catalytic surface properties in these metallic systems.

While the compound exhibits significant structural complexity with numerous reported configurations, it is identified as being above the thermodynamic hull. This suggests that the material is metastable, requiring specific synthesis conditions to stabilize its unique atomic arrangement for potential use in specialized chemical processes.

At a glance

Key Properties

Cross-validated computational properties for Ag1Be2Pt1, aggregated across 2 databases.

Band Gap

1.40 eV
Range across DFT structures

Energy Above Hull

2.086 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

27
2 databases, 14 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Ag1Be2Pt1, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic1.402.0858-2.2990.89
P4/mmm (No. 123)
P4/mmm (No. 123)
P4mm (No. 99)
Pmmm (No. 47)
P4/mmm (No. 123)
R3m (No. 160)
P4mm (No. 99)
Fm-3m (No. 225)
F-43m (No. 216)
C2/m (No. 12)
Fm-3m (No. 225)
Uses

Applications

Where Ag1Be2Pt1 is used.

Catalysis researchMaterials science studies
Reference

Frequently Asked Questions

Common questions about Ag1Be2Pt1, answered from cross-validated data.

What is Ag1Be2Pt1?

Ag1Be2Pt1 is a metastable, semiconducting platinum-group alloy used in advanced materials research.

More questions
What is Ag1Be2Pt1 used for?
Ag1Be2Pt1 is used in catalysis research and materials science studies.
What is the band gap of Ag1Be2Pt1?
Ag1Be2Pt1 has a DFT-computed band gap of 1.40 eV across 27 reported structures.
Is Ag1Be2Pt1 a metal, semiconductor, or insulator?
With a band gap up to 1.40 eV it is a semiconductor.
Is Ag1Be2Pt1 thermodynamically stable?
Ag1Be2Pt1 has a lowest energy above hull of 2.086 eV/atom (above hull).
What is the crystal structure of Ag1Be2Pt1?
The lowest-energy reported polymorph of Ag1Be2Pt1 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Ag1Be2Pt1?
The computed density of the ground-state structure of Ag1Be2Pt1 is 0.89 g/cm³.
How many polymorphs of Ag1Be2Pt1 are known?
27 structures of Ag1Be2Pt1 are reported across 2 databases, spanning 14 distinct space groups.
What elements does Ag1Be2Pt1 contain?
Ag1Be2Pt1 contains Ag, Be, and Pt (3 elements).
Where does the data for Ag1Be2Pt1 come from?
Ag1Be2Pt1 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, Ag1Be2Pt1 occupies a niche position compared to more stable or common phases like As2Pt or GeRu. Unlike these more robust members, its metastable nature highlights the synthetic challenges inherent in balancing silver, beryllium, and platinum to achieve specific catalytic functionality.

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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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