Literature DB >> 16178622

Star-branched polymers in an adsorbing slit: a Monte Carlo study.

Piotr Romiszowski1, Andrzej Sikorski.   

Abstract

A coarse-grained model of star-branched polymer chains confined in a slit was studied. The slit was formed by two parallel impenetrable surfaces, which were attractive for polymer beads. The polymer chains were flexible homopolymers built of identical united atoms whose positions in space were restricted to the vertices of a simple cubic lattice. The chains were regular star polymers consisted of f = 3 branches of equal length. The chains were modeled in good solvent conditions and, thus, there were no long-range specific interactions between the polymer beads-only the excluded volume was present. Monte Carlo simulations were carried out using the algorithm based on a chain's local changes of conformation. The influence of the chain length, the distances between the confining surfaces, and the strength of the adsorption on the properties of the star-branched polymers was studied. It was shown that the universal behavior found previously for the dimension of chains was not valid for some dynamic properties. The strongly adsorbed chains can change their position so that they swap between both surfaces with frequency depending on the size of the slit and on the temperature only.

Entities:  

Year:  2005        PMID: 16178622     DOI: 10.1063/1.2018634

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  2 in total

1.  Computer simulation of polypeptides in a confinement.

Authors:  Andrzej Sikorski; Piotr Romiszowski
Journal:  J Mol Model       Date:  2006-09-15       Impact factor: 1.810

2.  The structure of polymer chains in confinement. A Monte Carlo study.

Authors:  Piotr Romiszowski; Andrzej Sikorski
Journal:  J Mol Model       Date:  2009-03-05       Impact factor: 1.810

  2 in total

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