@inproceedings{9a7eb9ade7484b9a94288aefdfbd1b8f,
title = "A molecular dynamics study for dissociation of H 2 molecule on Pt(111) surface",
abstract = "The dissociation phenomena of H 2 molecule on Pt(111) surface was simulated by Molecular Dynamics (MD) method and the effect of motion of the gas molecule or surface atoms on dissociation phenomena was analyzed in detail. The Embedded Atom Method (EAM) was used to model the interaction between an H 2 molecule and Pt(111) surface. Using this potential, simulations of an H 2 molecule impinging on a Pt(111) surface were performed and the characteristics of the collision were observed. Using MD data the dynamic dissociation probability were obtained and compared with the static dissociation probability to analyze the effect of atomic motion on dissociation phenomena.",
keywords = "Catalysis, Dissociation, Hydrogen molecule, Molecular dynamics, Platinum surface",
author = "Takashi Tokumasu",
note = "Copyright: Copyright 2012 Elsevier B.V., All rights reserved.; 2011 International Conference on Management, Manufacturing and Materials Engineering, ICMMM 2011 ; Conference date: 08-12-2011 Through 10-12-2011",
year = "2012",
doi = "10.4028/www.scientific.net/AMR.452-453.1144",
language = "English",
isbn = "9783037853511",
series = "Advanced Materials Research",
pages = "1144--1148",
booktitle = "Management, Manufacturing and Materials Engineering",
}