Gibbs Energy of Hydrogen Adsorption on Pt Surface by Machine Learning Potential and Metadynamics-Reference-Cited by-同舟云学术

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Gibbs Energy of Hydrogen Adsorption on Pt Surface by Machine Learning Potential and Metadynamics

Published:2021-07-05 Issue:7 Volume:50 Page:1329-1332
ISSN:0366-7022
Container-title:Chemistry Letters
language:en
Short-container-title:Chem. Lett.

Author:

Hayashi Akihide¹,Ato Yoshinori¹,Yamamoto Akira²³,Yoshida Hisao²³,Yamanaka Shusuke¹,Kawakami Takashi¹,Okumura Mitsutaka¹²

Affiliation:

1. Department of Chemistry, Graduate School of Science, Osaka University, 1-32 Machikaneyama, Toyonaka, Osaka 563-0043, Japan

2. Graduate School of Human and Environmental Studies, Kyoto University, Yoshida Nihonmatsu-cho, Sakyo-ku, Kyoto 606-8501, Japan

3. Elements Strategy Initiative for Catalysts and Batteries (ESICB), Kyoto University, Nishikyo, Kyoto 615-8245, Japan

Publisher

The Chemical Society of Japan

Subject

General Chemistry

Link

http://www.journal.csj.jp/doi/pdf/10.1246/cl.210137

Reference24 articles.

1. Kinetic study of ethylene hydrogenation

2. Hydrogenation of Aromatic Hydrocarbons over Supported Pt Catalysts .II. Toluene Hydrogenation

3. Dynamics of Reactive Species and Reactant-Induced Reconstruction of Pt Clusters in Pt/Al2O3 Catalysts

4. Coadsorption of Butadiene and Hydrogen on the (111) Surfaces of Pt and Pt2Sn Surface Alloy: Understanding the Cohabitation from First-Principles Calculations

5. Escaping free-energy minima

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