Calculation of images of oriented C_60 molecules using molecular orbital theory

Using Hückel molecular-orbital theory, images are created to represent the electron distributions expected for a C60 molecule adsorbed on a substrate. Three different orientations of the C60 molecule on the substrate are considered. The effect of the interaction of the molecule with the substrate...

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Bibliographic Details
Main Authors: Hands, Ian D., Dunn, Janette L., Bates, Colin A.
Format: Article
Published: Americal Physical Society 2010
Subjects:
Online Access:https://eprints.nottingham.ac.uk/1328/