A combined Monte Carlo and Hückel theory simulation of orientational ordering in C60 assemblies

A combined Monte Carlo and Hückel theory simulation of orientational ordering in C60 assemblies

Orientational ordering of C60 molecules within monolayer and multilayer islands is a regularly observed phenomenon in scanning tunnelling microscopy (STM) studies. Here we simulate the orientational ordering seen in STM images via a novel combination of Monte Carlo and Hückel theory methods and comp...

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Bibliographic Details
Main Authors: Leaf, Jeremy, Stannard, Andrew, Jarvis, Samuel Paul, Moriarty, Philip, Dunn, Janette L.
Format: Article
Published: American Chemical Society 2016
Subjects:
Fullerene
C60
Monte-Carlo
Huckel
Orientational ordering
STM
Online Access:https://eprints.nottingham.ac.uk/33039/

Internet

https://eprints.nottingham.ac.uk/33039/

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