PbPtY2

PbPtY2 is a semiconducting intermetallic compound containing lead, platinum, and yttrium that is studied for its unique structural properties within the platinum-group alloy class.

Crystal structure of PbPtY2 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About PbPtY2

PbPtY2 is a specialized intermetallic compound categorized within the platinum-group alloy catalysts. As a semiconducting material, it represents a complex arrangement of lead, platinum, and yttrium that deviates from typical metallic behavior found in this class.

Due to its position above the thermodynamic hull, this compound is considered metastable, making it a subject of interest for researchers studying phase stability and synthetic pathways. Its limited structural data across databases highlights its status as an exploratory material in the broader landscape of catalytic alloys.

At a glance

Key Properties

Cross-validated computational properties for PbPtY2, aggregated across 3 databases.

Band Gap

0.11 eV
Range across DFT structures

Energy Above Hull

2.564 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

3
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for PbPtY2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.112.5643-35.5390.73
9.62
Uses

Applications

Where PbPtY2 is used.

Fundamental materials science researchExploratory catalytic studiesIntermetallic phase stability analysis
Reference

Frequently Asked Questions

Common questions about PbPtY2, answered from cross-validated data.

What is PbPtY2?

PbPtY2 is a semiconducting intermetallic compound containing lead, platinum, and yttrium that is studied for its unique structural properties within the platinum-group alloy class.

More questions
What is PbPtY2 used for?
PbPtY2 is used in fundamental materials science research, exploratory catalytic studies, and intermetallic phase stability analysis.
What is the band gap of PbPtY2?
PbPtY2 has a DFT-computed band gap of 0.11 eV across 3 reported structures.
Is PbPtY2 a metal, semiconductor, or insulator?
With a band gap up to 0.11 eV it is a semiconductor.
Is PbPtY2 thermodynamically stable?
PbPtY2 has a lowest energy above hull of 2.564 eV/atom (above hull).
What is the crystal structure of PbPtY2?
The lowest-energy reported polymorph of PbPtY2 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of PbPtY2?
The computed density of the ground-state structure of PbPtY2 is 0.73 g/cm³.
How many polymorphs of PbPtY2 are known?
3 structures of PbPtY2 are reported across 3 databases, spanning 1 distinct space group.
What elements does PbPtY2 contain?
PbPtY2 contains Pb, Pt, and Y (3 elements).
Where does the data for PbPtY2 come from?
PbPtY2 data is cross-referenced from materials_project, alexandria, omat24.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Unlike more stable and widely characterized members of the platinum-group alloy class such as As2Pt or GeRu, PbPtY2 exhibits a higher degree of thermodynamic instability. While many of its siblings are optimized for robust catalytic performance, this compound serves as a unique case study in how the inclusion of heavy elements like lead and rare-earth components like yttrium alters the electronic and structural landscape compared to simpler binary systems like BaPd.

Explore

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).
  • alexandria — Data from alexandria.
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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