Adsorption of CO on Pd(100): Steering into less favored adsorption sites

A. Eichler and J. Hafner
Phys. Rev. B 57, 10110 – Published 15 April 1998
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Abstract

Molecular steering effects have been shown already in a number of cases to constitute an effective mechanism to avoid barriers and enhance sticking at low incidence energies. We present a study of the adsorption process of CO on the Pd(100) surface, where a similar mechanism leads to trapping of some of the molecules in less favorable surface sites. The electronic charge transfers and redistributions connected with this process are analyzed in detail.

  • Received 5 December 1997

DOI:https://doi.org/10.1103/PhysRevB.57.10110

©1998 American Physical Society

Authors & Affiliations

A. Eichler and J. Hafner

  • Institut für Theoretische Physik and Center for Computational Materials Science, Technische Universität Wien, Wiedner Hauptstraße 8-10/136, A-1040 Wien, Austria

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Vol. 57, Iss. 16 — 15 April 1998

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