590 Recent Advances in Molecular Simulation Methods III

Wednesday, November 19, 2014: 3:15 PM
212 (Hilton Atlanta)
Description:
session III

Sponsor:
Computational Molecular Science and Engineering Forum
Co-Sponsor(s):
Thermodynamics and Transport Properties (01A)

Chair:
Erik E. Santiso
Email: eesantis@ncsu.edu

Co-Chair:
Vanessa Ortiz
Email: vortiz@columbia.edu

- indicates paper has an Extended Abstract file available on CD.


3:15 PM
(590a) Multi-Scale Theory in the Molecular Simulation of Electrolyte Solutions
Wei Zhang, Xinli You and Lawrence R. Pratt

3:40 PM
(590b) Incorporation of Proton Hopping Mechanism into Dissipative Particle Dynamics
Ming-Tsung Lee, Aleksey Vishnyakov and Alexander V. Neimark

4:05 PM
(590c) Surface Tension of Pure Components and Mixtures By Molecular Simulation
Stephan Werth, Katrin Stöbener, Martin Horsch and Hans Hasse

4:30 PM
Break

4:55 PM
(590e) Coarse-Grained Simulation of dsDNA-Dendrimer Complex Formation
Shi Yu and Ronald G. Larson
File available
5:20 PM
(590f) From Feedstock to Final Product: Toward Molecular Dynamics Simulations Encompassing All Stages of Single-Walled Carbon Nanotube Synthesis
Jonathan E. Mueller and William A. Goddard III
See more of this Group/Topical: Computational Molecular Science and Engineering Forum
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