Logo Logo
Hilfe
Hilfe
Switch Language to English

Rohr, Carsten; Balbás Gambra, Marta; Gruber, Kathrin; Höhl, Cornelia; Malarek, Michael S.; Scherer, Lukas J.; Constable, Edwin C.; Franosch, Thomas und Hermann, Bianca A. (2011): Predicting the influence of a p2-symmetric substrate on molecular self-organization with an interaction-site model. In: Chemical communications, Bd. 47: S. 1800-1802 [PDF, 1MB]

[thumbnail of Predicting_the_influence_of_a_p2-symmetric.pdf]
Vorschau

Download (1MB)

Abstract

An interaction-site model can a priori predict molecular selforganisation on a new substrate in Monte Carlo simulations. This is experimentally confirmed with scanning tunnelling microscopy on Fre´chet dendrons of a pentacontane template. Local and global ordering motifs, inclusion molecules and a rotated unit cell are correctly predicted.

Dokument bearbeiten Dokument bearbeiten