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An extended BFM model for simulation of copolymers at an interface

James, Emyr and Matthai, Clarence Cherian 1998. An extended BFM model for simulation of copolymers at an interface. Computational Materials Science 10 (1-4) , pp. 175-179. 10.1016/S0927-0256(97)00177-8

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Abstract

We have extended the original bond fluctuation model (BFM) of Carmesin and Kremer [Macromolecules 12 (1988) 2819] so that it allows for a threefold an increase in the possible bonding configurations. This appears to be computationally more efficient in determining equilibrium configurations. We have used this modified BFM to simulate random copolymers at the interface of two good solvents.

Item Type: Article
Date Type: Publication
Status: Published
Schools: Physics and Astronomy
Subjects: Q Science > QC Physics
Publisher: Elsevier
ISSN: 0927-0256
Last Modified: 04 Jun 2017 05:04
URI: http://orca-mwe.cf.ac.uk/id/eprint/47967

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