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Surface structure of In2O3(111) (1 x 1) determined by density functional theory calculations and low energy electron diffraction

Abstract:

The surface structure of In2O3(111) has been investigated by dynamical analysis of low energy electron diffraction data, in conjunction with first principles calculations using density functional theory. The experimental data set consisted of eight independent beams whose intensities were measured for incident energies in the range between 25 eV and 250 eV. In fitting the experimental data it was essential to treat the radii of In and O spheres as variable parameters: following this procedure...

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Publication status:
Published

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Publisher copy:
10.1016/j.susc.2011.07.014

Authors


Matilainen, A More by this author
Dhanak, VR More by this author
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Institution:
University of Oxford
Department:
Oxford, MPLS, Chemistry, Inorganic Chemistry
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Journal:
SURFACE SCIENCE
Volume:
606
Issue:
1-2
Pages:
1-6
Publication date:
2012-01-05
DOI:
ISSN:
0039-6028
URN:
uuid:f9b9fa33-b7ed-4fd0-8ebf-14008e7dae75
Source identifiers:
222604
Local pid:
pubs:222604

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