Reactive scattering of H2 from Cu(100): six-dimensional quantum dynamics results for reaction and scattering obtained with a new, accurately fitted potential-energy surface

M.F. Somers, R.A. Olsen, H.F. Busnengo, E.J. Baerends, G. Kroes

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Abstract

Six-dimensional quantum dynamical calculations are reported for the dissociative chemisorption of (v = 0, 1, j = 0) H
Original languageEnglish
Pages (from-to)11379-87
JournalJournal of Chemical Physics
Volume121
Issue number22
DOIs
Publication statusPublished - 2004

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