Wednesday, March 6, 2024
11:30AM - 12:06PM
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N32.00001: Predicting Covalent Organic Framework (COF) Membrane Performance by Mapping Molecular Interactions in Mixed Solvents via Atomistic Modeling
Invited Speaker:
Katie D Li-Oakey
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Wednesday, March 6, 2024
12:06PM - 12:18PM
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N32.00002: Ion-ion Separations in Biomimetic Water Channels
Tyler J Duncan, Harekrushna Behera, Paul R Irving, Nico Marioni, Harnoor S Sachar, Meron Y. Tadesse, Zidan Zhang, Everett S Zofchak, Manish Kumar, Venkatraghavan Ganesan
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Wednesday, March 6, 2024
12:18PM - 12:30PM
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N32.00003: Characterization of ion binding guided by ∆∆G and mobility calculations in ethylene oxide-rich environments
Ramón González-Pérez, Alexander W Dowling, William A Phillip, Jonathan K Whitmer
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Wednesday, March 6, 2024
12:30PM - 12:42PM
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N32.00004: Studies of Li ion conduction mechanism for zwitterionic polymer electrolytes using molecular dynamics simulations
Mizuki Kamata, Amalie L Frischknecht, Kris T Delaney, Glenn H Fredrickson
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Wednesday, March 6, 2024
12:42PM - 12:54PM
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N32.00005: Gas permeance in polymer membranes: computational approaches near and far from ideal behavior
Samuel J Layding, Gabrielle Dobkin, Robert A Riggleman
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Wednesday, March 6, 2024
12:54PM - 1:06PM
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N32.00006: Role of hydration on ion transport in the transition from dry to wet salt-doped PEO
Nico Marioni, Oscar Nordness, Rahul Sujanani, Akhila Rajesh, Zidan Zhang, Benny D Freeman, Rachel A Segalman, Raphaële J Clément, Venkatraghavan Ganesan
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Wednesday, March 6, 2024
1:06PM - 1:18PM
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N32.00007: Microscopic theory of the effects of penetrant shape on activated dynamics and selectivity in polymer melts and crosslinked networks
Baicheng Mei, Kenneth S Schweizer
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Wednesday, March 6, 2024
1:18PM - 1:30PM
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N32.00008: Investigating the effect of hydration ratios on hydroxide conductivity in anion exchange membranes from non-reactive molecular dynamics simulations
Janani Sampath
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Wednesday, March 6, 2024
1:30PM - 1:42PM
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N32.00009: Impact of Morphology on Water Dynamics in Hydrated Copolymers for Proton Exchange Membranes
Max S Win, Amalie L Frischknecht, Karen I Winey, Victoria S Lee
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Wednesday, March 6, 2024
1:42PM - 1:54PM
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N32.00010: Finding non-aqueous proton conductors for polymer-based electrolytes using density functional theory
Yifan Liu, Valentino R Cooper
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Wednesday, March 6, 2024
1:54PM - 2:06PM
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N32.00011: Computational Analysis of Small Angle Scattering Measurements on Polymer Membranes
Stephen Kronenberger, Nitant Gupta, Jason Madinya, Arthi Jayaraman
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Wednesday, March 6, 2024
2:06PM - 2:18PM
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N32.00012: Polyethylene-block-polyacrylate based block copolymers for high ionic conductivity polymer electrolytes
Maninderjeet Singh, Alamgir Karim, Eva Harth, Siddharaj Dabade
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