Six-dimensional quantum dynamics for the dissociative chemisorption of HCl on rigid Ag(111) on three potential energy surfaces with different density functionals-Reference-Cited by-同舟云学术

Six-dimensional quantum dynamics for the dissociative chemisorption of HCl on rigid Ag(111) on three potential energy surfaces with different density functionals

Published:2018-11-07 Issue:17 Volume:149 Page:174702
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Liu Tianhui¹,Fu Bina¹^ORCID,Zhang Dong H.¹

Affiliation:

1. State Key Laboratory of Molecular Reaction Dynamics and Center for Theoretical and Computational Chemistry, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian 116023, People’s Republic of China

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.5053827

Reference73 articles.

1. Observation of Direct Vibrational Excitation in Gas-Surface Collisions: NO on Ag(111)

2. Rotationally inelastic gas–surface scattering: HCl from Au(111)

3. Effect of rotation on the translational and vibrational energy dependence of the dissociative adsorption of D2on Cu(111)

4. CH4 dissociation on Ni(100): Comparison of a direct dynamical model to molecular beam experiments

5. Surface reactivity of highly vibrationally excited molecules prepared by pulsed laser excitation: CH4 (2ν3) on Ni(100)

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