Molecular Dynamics Study of Hydrogen Dissociation on Pd Surfaces using Reactive Force Fields-Reference-Cited by-同舟云学术

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Molecular Dynamics Study of Hydrogen Dissociation on Pd Surfaces using Reactive Force Fields

Published:2017-02-27 Issue:1 Volume:30 Page:71-76
ISSN:1674-0068
Container-title:Chinese Journal of Chemical Physics
language:en
Short-container-title:Chin. J. Chem. Phys.

Author:

Sun Yue-mei¹,Shen Xiang-jian²,Yan Xiao-hong¹

Affiliation:

1. College of Science, Nanjing University of Aeronautics and Astronautics, Nanjing 210016, China

2. Research Center of Heterogeneous Catalysis and Engineering Sciences, School of Chemical Engineering and Energy, Zhengzhou University, Zhengzhou 450001, China

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry

Reference32 articles.

1. H. A. Michelsen, C. T. Rettner, and D. J. Auerbach, Surface Reactions, Springer Series in Surface Science Vol. 34, Berlin: Springer-Verlag, 185 (1994).

2. Towards Bond Selective Chemistry from First Principles: Methane on Metal Surfaces

3. The dissociation of diatomic molecules at surfaces

4. Quantum Theory of Dissociative Chemisorption on Metal Surfaces

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