Self-assembly on multiple length scales: A Monte Carlo algorithm with data augmentation

Alessandro Troisi*, Vance Wong, Mark A. Ratner

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

12 Scopus citations

Abstract

We present a Monte Carlo algorithm that allows simulations where portions of the system of variable size are moved. The algorithm requires the definition of an augmented space that contains information on the bonding between components of the system and is updated as the simulation proceeds. With this method it is possible to incorporate, within the same simulation, processes involving motion of smaller and larger portions of a given system. The algorithm is presented in general terms and illustrated for a simple one-dimensional lattice model.

Original languageEnglish (US)
Article number024102
JournalJournal of Chemical Physics
Volume122
Issue number2
DOIs
StatePublished - 2005

ASJC Scopus subject areas

  • General Physics and Astronomy
  • Physical and Theoretical Chemistry

Fingerprint

Dive into the research topics of 'Self-assembly on multiple length scales: A Monte Carlo algorithm with data augmentation'. Together they form a unique fingerprint.

Cite this