Crotonaldehyde Adsorption on Cu-Pt Surface Alloys: A Quantum Mechanics Study

Crotonaldehyde Adsorption on Cu-Pt Surface Alloys: A Quantum Mechanics Study

The adsorption of crotonaldehyde on Cu-Pt alloy surfaces was characterized by density functional theory (DFT). Two surfaces were considered: Cu<sub>2</sub>Pt/Cu(111) and Cu<sub>3</sub>Pt/Cu(111). It was determined that the presence of Pt on the surface, even when isolated as...

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Bibliographic Details
Main Authors: Ricardo Ruvalcaba, Jonathan Guerrero-Sanchez, Noboru Takeuchi, Francisco Zaera
Format: Article
Language:English
Published: MDPI AG 2023-03-01
Series:Chemistry
Subjects:
catalysis
single-atom alloys
selective hydrogenation
unsaturated aldehydes
density functional theory
Online Access:https://www.mdpi.com/2624-8549/5/1/34

Internet

https://www.mdpi.com/2624-8549/5/1/34

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