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Molecular dynamics study of the molecular weight dependence of surface tensions of normal alkanes and methyl methacrylate oligomers

Authors :
Chunll Li
Choi, Phillip
Source :
Journal of Physical Chemistry B. April 6, 2006, Vol. 110 Issue 13, 6864-6870
Publication Year :
2006

Abstract

Surface tensions (gamma) of normal alkanes and methyl methacrylate (MMA) oligomers at various molecular weights in the low molecular weight range are calculated using a new molecular dynamics simulation strategy. The MD simulations, even with the use of a generic force field, reproduced the experimentally observed molecular weight dependence of gamma for both series of oligomers.

Details

Language :
English
ISSN :
15206106
Volume :
110
Issue :
13
Database :
Gale General OneFile
Journal :
Journal of Physical Chemistry B
Publication Type :
Academic Journal
Accession number :
edsgcl.151407050