Determination of Adsorbate Geometries from Intramolecular Scattering in Deep-Core-Level X-Ray Photoemission: CO on Ni(001)

L. -G. Petersson, S. Kono, N. F. T. Hall, C. S. Fadley, and J. B. Pendry
Phys. Rev. Lett. 42, 1545 – Published 4 June 1979
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Abstract

In angle-resolved x-ray photoemission from the C 1s level of CO adsorbed on Ni(001), a peak in intensity with magnitude ImaxIback1.5 and full width at half maximum ≈ 25° is found to point along the surface normal. Single-scattering calculations for both a single CO molecule and a finite cluster verify that this peak is due to intramolecular scattering by O. The average orientation of CO is thus determined to be within 12° of normal, with an undetermined rms vibrational notion of ≲ 35°.

  • Received 29 January 1979

DOI:https://doi.org/10.1103/PhysRevLett.42.1545

©1979 American Physical Society

Authors & Affiliations

L. -G. Petersson, S. Kono, and N. F. T. Hall

  • Department of Chemistry, University of Hawaii, Honolulu, Hawaii 96822

C. S. Fadley*

  • Laboratoire pour l'Utilisation du Rayonnement Electromagnétique, Université de Paris-Sud et Centre National de la Recherche Scientifique, 91405 Orsay, France

J. B. Pendry

  • Daresbury Laboratory, Science Research Council, Daresbury, Warrington WA4 4AD, United Kingdom

  • *Permanent address: Department of Chemistry, University of Hawaii, Honolulu, Haw. 96822.

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Issue

Vol. 42, Iss. 23 — 4 June 1979

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