DY 10: Modeling and Simulation of Soft Matter (joint session CPP/DY)
Monday, September 5, 2022, 15:00–17:45, H39
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15:00 |
DY 10.1 |
Machine Learning of consistent thermodynamic models using automatic differentiation — •David Rosenberger, Kipton Barros, Timothy Germann, and Nicholas Lubbers
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15:15 |
DY 10.2 |
Atomistic Machine Learning for Aqueous Ionic Solutions — •Philip Loche, Kevin K. Huguenin-Dumittan, and Michele Ceriotti
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15:30 |
DY 10.3 |
Identification of glass transition temperature for polymer melts using data-driven methods — •Atreyee Banerjee, Hsiao-ping Hsu, Oleksandra Kukharenko, and Kurt Kremer
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15:45 |
DY 10.4 |
Systematic parametrization of non-Markovian dissipative thermostats for coarse-grained molecular simulations with accurate dynamics — •Viktor Klippenstein and Nico F. A. Van Der Vegt
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16:00 |
DY 10.5 |
The contribution has been withdrawn.
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16:15 |
DY 10.6 |
Modulating internal transition kinetics of responsive macromolecules by collective crowding — •Nils Göth, Upayan Baul, Michael Bley, and Joachim Dzubiella
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16:30 |
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15 min. break
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16:45 |
DY 10.7 |
Modelling process-structure-properties of polymer nanocomposites — •Janett Prehl, Constantin Huster, and Karl Heinz Hoffmann
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17:00 |
DY 10.8 |
A cosolvent surfactant mechanism affects polymer collapse in miscible good solvents — •Swaminath Bharadwaj, Divya Nayar, Cahit Dalgicdir, and Nico van der Vegt
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17:15 |
DY 10.9 |
Water transport in soft nanoporous materials: Impact of mechanical response on dynamics, slippage and permeance — •Alexander Schlaich, Matthieu Vandamme, Marie Plazanet, and Benoit Coasne
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17:30 |
DY 10.10 |
Solvation structure of polymer cathodes for Li/S batteries — •Diptesh Gayen, Yannik Schuetze, Sebastien Groh, and Joachim Dzubiella
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