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Theoretical modelling of tip-induced manipulation of C-60 on the Si(001) surface

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Martsinovich, Natalia and Kantorovich, L. (2009) Theoretical modelling of tip-induced manipulation of C-60 on the Si(001) surface. In: International Conference on Physics, Chemistry and Application of Nanostructures, Minsk, Russia, May 26-29, 2009. Published in: Physics, Chemistry and Application of Nanostructure pp. 499-502. ISBN 978-981-4280-35-8.

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Abstract

Constant height repulsive (pushing mode) manipulation of a C-60 molecule covalently bound to the Si(001) surface is modelled using ab initio density functional theory, with the scanning tunneling microscope tip included explicitly in the calculations. The formation of chemical bonds between the tip and the molecule is demonstrated. The bonds between the molecule, tip and surface are constantly rearranging, so that a continuous manipulation process is possible. Tip-induced manipulation considered here is compared with the tip-free model, and the effects due to the tip are discussed.

Item Type: Conference Item (Paper)
Subjects: Q Science > QD Chemistry
T Technology
Q Science > QC Physics
Divisions: Faculty of Science, Engineering and Medicine > Science > Chemistry
Journal or Publication Title: Physics, Chemistry and Application of Nanostructure
Publisher: World Scientific Publishing Co. Pte. Ltd.
ISBN: 978-981-4280-35-8
Editor: Borisenko, VE and Gaponenko, SV and Gurin, VS
Official Date: 2009
Dates:
DateEvent
2009Published
Number of Pages: 4
Page Range: pp. 499-502
Status: Peer Reviewed
Publication Status: Published
Access rights to Published version: Restricted or Subscription Access
Conference Paper Type: Paper
Title of Event: International Conference on Physics, Chemistry and Application of Nanostructures
Type of Event: Conference
Location of Event: Minsk, Russia
Date(s) of Event: May 26-29, 2009

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