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General Model for Water Monomer Adsorption on Close-Packed Transition and Noble Metal Surfaces

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Michaelides, A., Ranea, V. A., de Andres, P. L., King, D. A.·2003·Physical Review Letters

Abstract

Ab initio density functional theory has been used to investigate the adsorption of H2O on several close-packed transition and noble metal surfaces. A remarkably common binding mechanism has been identified. On every surface H2O binds preferentially at an atop adsorption site with the molecular dipole plane nearly parallel to the surface. This binding mode favors interaction of the H2O 1b(1) delocalized molecular orbital with surface wave functions.

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Metadata

Authors
Michaelides, A., Ranea, V. A., de Andres, P. L., & King, D. A.
Venue
Physical Review Letters
Published
2003-05-27
Volume
90
Issue
21
Pages
216102-216102
ISSN
  • 0031-9007 (ISSN-L)
  • 1079-7114
OpenAlex
W2045103600
Cited by
408
References
0
FWCI
13.07
Type
journal article
Language
en
Open access
green

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CoChat. (2026). Citation check: General Model for Water Monomer Adsorption on Close-Packed Transition and Noble Metal Surfaces. https://app.cochat.ai/papers/10.1103/physrevlett.90.216102
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Michaelides, A., Ranea, V. A., de Andres, P. L., & King, D. A. (2003). General Model for Water Monomer Adsorption on Close-Packed Transition and Noble Metal Surfaces. Physical Review Letters. https://doi.org/10.1103/physrevlett.90.216102

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Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).

Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.