521 Multiscale and Coarse-Grained Modeling of Polymers


Description:
This session focuses on multiscale simulation to characterize the behavior of polymeric materials and produce insight into structure property relationships. The appropriate simulation protocols span or connect two or more scales of time, size or detail in the polymeric materials. ***Note to faculty candidates: please include a note to the session chair during submission to alert them to your status*** +++Note: this session will be sorted jointly with Atomistic and Molecular Modeling and Simulations of Polymers. Authors may submit to either session.+++

Sponsor:
Polymers


Chair:
Jian Qin
Assistant Professor
Stanford University
Chemical Engineering
Stanford, CA
Phone Number: 650-724-7644
Email: jianq@stanford.edu

Co-Chair:
Douglas Tree
Assistant Professor
Brigham Young University
Chemical Engineering
Provo, UT
55455
Phone Number: (801) 310-6115
Email: tree.doug@byu.edu


Papers:
521a
Structure and Dynamics in Sulfonated Polyphenylenes from Atomistic and Coarse-Grained Simulations
Amalie L. Frischknecht, Sandia National Laboratories
521b
Developing Chemically Specific Coarse-Grained Conjugated Polymer Models Using the Taffi Framework
Brett Savoie, Purdue University
521c
Accessing Phase Behavior of Block Copolymer Grafted Nanoparticles Using Coarse-Grained Simulations and Protracted Colored Noise Dynamics
Andrew Peters, Louisiana Tech University
521d
Mesoscale Modeling of Polymer Solutions Under Flow
Michael P. Howard, Princeton University; Antonia Statt, Princeton University; Arash Nikoubashman, Johannes Gutenberg University Mainz; Athanassios Z. Panagiotopoulos, Princeton University
521e
Formation, Stability, and Annihilation of a “Stitch” Morphology in Block Copolymer Thin Films
Cody Bezik, University of Chicago; Juan J. de Pablo, University of Chicago
521f
Coarse-Grained Molecular Simulation Studies of Melting Thermodynamics of Oligonucleic Acids Conjugated with Polymers
Prhashanna Ammu, University of Delaware; Arthi Jayaraman, University of Delaware
521g
Versatile Hybrid Particle-Field Approach for Simulating Inhomogeneous Polymeric Systems
Dong Meng, Mississippi State University; Jing Zong, Mississippi State University
521h
Systematic and Many-Chain-Simulation-Free Coarse Graining of Polymer Melts: Structure-Based Coarse Graining of the Kremer-Grest Model
Yan Wang, Colorado State University; Qiang (David) Wang, Colorado State University
521i
Small Ion Effects on Self-Coacervation Phenomena in Block Polyampholytes
Scott P.O. Danielsen, University of California, Santa Barbara; Kris Delaney, University of California, Santa Barbara; Glenn H. Fredrickson, University of California, Santa Barbara
Abstract Submissions Closed
See more of this Group/Topical: Materials Engineering and Sciences Division
<< Previous Session | Next Session >>