Volume 114, 1999
From the journal:

Faraday Discussions

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

M. Polcik,   R. Lindsay,   P. Baumgärtel,   R. Terborg,   O. Schaff,   S. Kulkarni,   A. M. Bradshaw,   R. L. Toomes  and  D. P. Woodruff  

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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Article information

DOI
https://doi.org/10.1039/A902212K
Article type
Paper

Faraday Discuss., 1999,114, 141-155

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

M. Polcik, R. Lindsay, P. Baumgärtel, R. Terborg, O. Schaff, S. Kulkarni, A. M. Bradshaw, R. L. Toomes and D. P. Woodruff, Faraday Discuss., 1999, 114, 141 DOI: 10.1039/A902212K

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