Adsorption of atomic and molecular oxygen on Cu(1 0 0)

نویسندگان

  • A. Puisto
  • H. Pitkänen
  • M. Alatalo
  • S. Jaatinen
  • P. Salo
  • A. S. Foster
  • T. Kangas
  • K. Laasonen
چکیده

We have studied the initial stages of the oxidation of the Cu(1 0 0) surface using ab initio calculations. Both atomic and molecular oxygen are addressed. We show that subsurface oxygen is not energetically favourable, but gets stabilized by on-surface O. We discuss the adsorption of molecular oxygen using elbow plots, which can be used in order to qualitatively understand the measured sticking coefficient at different oxygen coverages. # 2004 Elsevier B.V. All rights reserved.

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تاریخ انتشار 2005