A novel algorithm for creating density dependent, coarse-grained models for the simulation of surfactant systems

Thesis (Ph. D.)--Massachusetts Institute of Technology, Dept. of Chemical Engineering, 2008. === Includes bibliographical references. === Large-scale simulations of solvated molecules that treat the solvent explicitly are very computationally expensive, and as a result work has been done on modifyin...

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Bibliographic Details
Main Author: Allen, Erik Christian
Other Authors: Gregory C. Rutledge.
Format: Others
Language:English
Published: Massachusetts Institute of Technology 2009
Subjects:
Online Access:http://hdl.handle.net/1721.1/45919