Internal structure of a model micelle via computer simulation
Journal of Physical Chemistry (1984)
- ISSN: 00223654
- DOI: 10.1021/j150669a062
Available from pubs.acs.org
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Abstract
The molecular dynamics method has been used in a preliminary computer simulation study of intramicellar structure. The simulation was performed on a simplified model of a spherical micelle composed of 40 13-member chains with head groups fixed on a spherical shell of 16 A radius. Results are reported for the local density of CH2 and CH, groups, for the distribution of gauche bonds, and for the average conformation of the chains.
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