28 May 2017 to 2 June 2017
Queen's University
America/Toronto timezone
Welcome to the 2017 CAP Congress! / Bienvenue au congrès de l'ACP 2017!

String method study of heterogeneous nucleation in block copolymers

30 May 2017, 12:15
15m
BioSci 1102 (Queen's University)

BioSci 1102

Queen's University

CLOSED - Oral (Student, In Competition) / Orale (Étudiant(e), inscrit à la compétition) Condensed Matter and Materials Physics / Physique de la matière condensée et matériaux (DCMMP-DPMCM) T2-1 Computational and Theoretical Condensed Matter (DCMMP) | Matière condensée numérique et théorique (DPMCM)

Speaker

Ms Sarah Dawson (McMaster University)

Description

The self-assembly of block copolymers into ordered microphases typically proceeds through nucleation. The free-energy barrier and the nucleation pathway are altered in the presence of a nucleating agent. By exploiting this fact, recent theoretical work has shown that an appropriately designed substrate may be used to fabricate defect-free films of block copolymers in an ordered phase. In this work, we look at a method for quantifying the effect of heterogeneities on the nucleation pathway in a model system. We find the minimum free energy path between the initial, metastable state and the stable state using the string method. We investigate the change in height of the free-energy barrier when the interface is included. The results obtained are compared with those from classical nucleation theory.

Authors

Ms Sarah Dawson (McMaster University) Dr An-Chang Shi (McMaster University)

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