Pt4Se6Tl2

Pt4Se6Tl2 is a stable, semiconducting platinum-group alloy used in advanced catalytic research.

Crystal structure of Pt4Se6Tl2
Ground-state structure · Materials Project
Overview

About Pt4Se6Tl2

Pt4Se6Tl2 is a distinct member of the platinum-group alloy catalysts, characterized by its semiconducting electronic nature. As a thermodynamically stable phase residing on the convex hull, it represents a robust structural arrangement that is highly favorable for specialized material synthesis.

Its significance lies in the strategic integration of platinum with selenium and thallium, creating a complex lattice that supports specific charge transport properties. This compound is primarily investigated for its potential in high-performance catalytic systems where stability and electronic tuning are critical requirements.

At a glance

Key Properties

Cross-validated computational properties for Pt4Se6Tl2, aggregated across 3 databases.

Band Gap

0.46 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

4
3 databases, 1 space group
Uses

Applications

Where Pt4Se6Tl2 is used.

Advanced catalytic systemsSemiconductor material researchElectrochemical energy conversion
Reference

Frequently Asked Questions

Common questions about Pt4Se6Tl2, answered from cross-validated data.

What is Pt4Se6Tl2?

Pt4Se6Tl2 is a stable, semiconducting platinum-group alloy used in advanced catalytic research.

More questions
What is Pt4Se6Tl2 used for?
Pt4Se6Tl2 is used in advanced catalytic systems, semiconductor material research, and electrochemical energy conversion.
What is the band gap of Pt4Se6Tl2?
Pt4Se6Tl2 has a DFT-computed band gap of 0.46 eV across 4 reported structures.
Is Pt4Se6Tl2 a metal, semiconductor, or insulator?
With a band gap up to 0.46 eV it is a semiconductor.
Is Pt4Se6Tl2 thermodynamically stable?
Yes — Pt4Se6Tl2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Pt4Se6Tl2 are known?
4 structures of Pt4Se6Tl2 are reported across 3 databases, spanning 1 distinct space group.
What elements does Pt4Se6Tl2 contain?
Pt4Se6Tl2 contains Pt, Se, and Tl (3 elements).
Where does the data for Pt4Se6Tl2 come from?
Pt4Se6Tl2 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Unlike metallic platinum-group alloys such as P3Ru or LaRh, Pt4Se6Tl2 distinguishes itself through its semiconducting electronic character. While many members of this class, including As2Pt and GeRu, are primarily metallic, this compound offers a unique electronic profile that bridges the gap between traditional noble metal catalysts and semiconductor materials.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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

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