Large scale molecular dynamics simulation of self-assembly processes in short and long chain cationic surfactants

Physics – Condensed Matter – Soft Condensed Matter

Scientific paper

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44 pages (18 figures), high resolution figures available on request. Accepted for publication in Phys. Chem. Chem. Phys

Scientific paper

10.1039/a905216j

We report on an investigation of the structural and dynamical properties of
n-nonyltrimethylammonium chloride (C9TAC) and erucyl bis [2-hydroxyethyl]
methylammonium chloride (EMAC) micelles in aqueous solution. A fully atomistic
description was used, and the time evolution was computed using molecular
dynamics.

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