606 Polymer Simulations: Molecular Structure and Function

Friday, November 20, 2020: 8:00 AM - 9:00 AM
Materials Engineering and Sciences Division (08) (PreRecorded+)

Description:
This session focuses on the simulation of polymeric materials. Topics of interest include, but are not limited to, development of new modeling and simulation techniques, application of modeling and simulation to provide insight into the properties and behavior of polymeric materials, and the development and use of atomistic, multiscale, and coarse-grained modeling of polymeric materials. ***Note to faculty candidates: please include a note to the session chair during submission to alert them to your status***

Sponsor:
Polymers
Chair:
Jian Qin Email: jianq@stanford.edu
Co-Chair:
Lisa M. Hall Email: hall.1004@osu.edu


(606a) Thermodynamics and Kinetics of the Self-Assembly of Multiblock Oligomers
Fernando Escobedo


(606c) Thermodynamics of Litfsi in Poly(ethylene oxide)-Based Electrolytes
Chao Fang, Whitney S. Loo and Rui Wang


(606d) Molecular Simulation of CO2 Sorption Effects on Structure and Local Dynamics of Polystyrene Melts
Eleonora Ricci, Niki Vergadou, Georgios G. Vogiatzis, Maria Grazia De Angelis and Doros N. Theodorou


(606f) Molecular Dynamics Simulations Predict That Semiconducting Polymers Behave As Ribbons
Samuel E. Root and Darren Lipomi


(606g) Computational Study of MOF-Polymer Compatibility in Mixed Matrix Membranes
Sanket Deshmukh, Abhishek Sose and Samrendra Singh


(606h) Building an Atomistic Model for Highly-Doped PEDOT Oligomers
Wesley Michaels and Jian Qin


(606i) Highly Stable Two-Dimensional Polyarylene Materials and Interfaces
Steve Lustig, Jan W. Andzelm and Eric D. Wetzel
See more of this Group/Topical: Materials Engineering and Sciences Division
<< Previous Session | Next Session >>