2020 Virtual AIChE Annual Meeting

Session: Polymer Simulations: Coarse-grained and Multi-scale

Chair

Li Xi, McMaster University

Co-Chair

Steven Lustig, Northeastern University

Presentations

08:00 AM

(382a) A Combined Bottom-up and Top-Down Coarse-Graining Approach to Develop Polymer Models
Erik Santiso, Jan Genzer, Christopher Walker

08:15 AM

(382b) Measuring Packing Length in Simulations for Different Polymer Architectures
Sai Vineeth Bobbili, Scott T. Milner

08:30 AM

(382c) Mesoscale Simulations of Surface-Grafted Polymers in Binary Solvent Mixtures: Effects of Cononsolvency
Dong Meng, Jing Zong

08:45 AM

(382d) Phase Behavior of Polymer-Grafted Nanoparticles in Solution
Amalie Frischknecht, Andrew P. Santos, Richard Vaia, Sarah N. Izor, Allen B. Schantz

09:00 AM

(382e) Parameterization of Dynamically Consistent Coarse-Grained Models of Chemically Specific Polymer Melts
Lilian C. Johnson, Frederick Phelan

09:15 AM

(382f) Precise Ordering of Block Copolymer Grafted Nanoparticles: Coarse-Grained Simulations
Andrew Peters, S. M. Al Islam Ovy, Joshua Obinwa

09:30 AM

(382g) Multiscale Modeling of Stratum Corneum Lipid Membranes
Chris Iacovella, Parashara Shamaprasad, Chloe Frame, Annette Bunge, Clare McCabe

09:45 AM

(382h) Coarse-Grained Models for the Solution Self-Assembly of Block Copolymer Polymer Bottlebrushes
Charles Sing, Tianyuan Pan, Damien Guironnet, Ying Diao, Dylan Walsh, Bijal Patel

10:00 AM

(382i) Coarse-Grained Simulations of Polymer Electrolytes: Ion Correlations and Transference Number
Kuan-Hsuan Shen, Lisa Hall