Literature DB >> 21132165

Predicting the influence of a p2-symmetric substrate on molecular self-organization with an interaction-site model.

Carsten Rohr1, Marta Balbás Gambra, Kathrin Gruber, Cornelia Höhl, Michael S Malarek, Lukas J Scherer, Edwin C Constable, Thomas Franosch, Bianca A Hermann.   

Abstract

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

Entities:  

Year:  2010        PMID: 21132165     DOI: 10.1039/c0cc03603j

Source DB:  PubMed          Journal:  Chem Commun (Camb)        ISSN: 1359-7345            Impact factor:   6.222


  2 in total

1.  Simulating self-organized molecular patterns using interaction-site models.

Authors:  M Balbás Gambra; C Rohr; K Gruber; B A Hermann; T Franosch
Journal:  Eur Phys J E Soft Matter       Date:  2012-03-30       Impact factor: 1.890

2.  Growth of a self-assembled monolayer decoupled from the substrate: nucleation on-command using buffer layers.

Authors:  Robby Reynaerts; Kunal S Mali; Steven De Feyter
Journal:  Beilstein J Nanotechnol       Date:  2020-09-01       Impact factor: 3.649

  2 in total

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