Reaction pathways for pyridine adsorption on silicon (0 0 1)

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Reaction pathways for pyridine adsorption on silicon (0 0 1)

Density functional theory is used to describe the reactions of chemisorption of pyridine on the silicon (0 0 1) surface. Adsorption energies of six relevant structures, and the activation energies between them are reported. We consider in detail the dative to tight-bridge transition for which confli...

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Bibliographic Details
Main Authors:	Bennett, J., Marks, Nigel, Miwa, J., Lopinski, G., Rosei, F., McKenzie, D., Warschkow, O.
Format:	Journal Article
Published:	Institute of Physics Publishing 2015
Online Access:	http://hdl.handle.net/20.500.11937/15476

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