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  Structure determination of molecular adsorbates on oxide surfaces using scanned-energy mode photoelectron diffraction

Polcik, M., Lindsay, R., Baumgärtel, P., Terborg, R., Schaff, O., Kulkarni, S., et al. (1999). Structure determination of molecular adsorbates on oxide surfaces using scanned-energy mode photoelectron diffraction. Faraday Discussions, 114, 141-155. doi:10.1039/A902212K.

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Item Permalink: https://hdl.handle.net/21.11116/0000-0008-DC45-3 Version Permalink: https://hdl.handle.net/21.11116/0000-0008-DC47-1
Genre: Journal Article

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 Creators:
Polcik, Martin1, Author           
Lindsay, Robert2, 3, Author           
Baumgärtel, Peter2, Author           
Terborg, Ralf2, Author           
Schaff, Oliver2, Author           
Kulkarni, S.2, Author           
Bradshaw, Alexander M.2, Author           
Toomes, R. L.4, Author
Woodruff, D. P.4, Author
Affiliations:
1Chemical Physics, Fritz Haber Institute, Max Planck Society, ou_24022              
2Fritz Haber Institute, Max Planck Society, ou_24021              
3Chemistry Department, University of Manchester, UK, ou_persistent22              
4Physics Department, University of Warwick, UK, ou_persistent22              

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 Abstract: Using N 1s scanned-energy mode photoelectron diffraction (PhD) combined with full multiple scattering simulations the local adsorption site of NO on NiO(100) has been determined. The molecule bonds through the N atom atop a surface layer N atom, while the N–O axis is tilted away from the surface normal by 59(+31/-17)°. The special problems presented by adsorbates on compound surfaces, for the direct inversion of PhD data to provide a first-order site determination, are discussed and some alternative schemes tested.

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Language(s): eng - English
 Dates: 1999-03-191999
 Publication Status: Issued
 Pages: 15
 Publishing info: -
 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1039/A902212K
 Degree: -

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Title: Faraday Discussions
  Abbreviation : Faraday Discuss.
Source Genre: Journal
 Creator(s):
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Publ. Info: London : Royal Society of Chemistry
Pages: 15 Volume / Issue: 114 Sequence Number: - Start / End Page: 141 - 155 Identifier: ISSN: 1359-6640
CoNE: https://pure.mpg.de/cone/journals/resource/954925269326