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Theoretical research of mixed-valence transition metal complex for molecular computing

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3 Author(s)
Peiji Zhao ; Dept. of Electr. & Comput. Eng., North Carolina State Univ., Raleigh, NC, USA ; Woolard, D. ; Seminario, J.M.

In this paper, in terms of density functional theory, we study the attachment of mixed-valence transition metal complex molecules through the linker molecules to the surface of the silicon or other materials. The effects of the linker molecules and the surface of silicon on the energy structure of mixed-valence transition metal complex molecules are also considered. The criteria for packing up suitable molecules for QCA cells are discussed.

Published in:

Nanotechnology, 2004. 4th IEEE Conference on

Date of Conference:

16-19 Aug. 2004