Spotlights in Thermodynamics and Computational Molecular Science (Invited Talks) | AIChE

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Spotlights in Thermodynamics and Computational Molecular Science (Invited Talks)

Chair(s)

Nangia, S., Syracuse University

Co-chair(s)

Shell, S., University of California Santa Barbara

Spotlights in Thermodynamics and Computational Molecular Science (Invited Talks)

Presentations

12:30 PM
Introductory Remarks
12:35 PM
(516a) Far and Few in between: Probing Structure-Selectivity Relationship in Membranes Using Path Sampling Techniques
12:55 PM
(516b) Physics-Inspired Machine Learning Potentials for Unraveling Mysteries in Electrolyte Solutions
1:15 PM
(516c) Understanding Ionomer Membrane Structure Via Analysis of Small Angle Scattering Profiles and Coarse-Grained Molecular Simulations
1:35 PM
(516d) Assembly of Short Amphiphilic Peptoids into Nanohelices with Controllable Supramolecular Chirality: Insights from Computational Simulation and Theoretical Analysis
1:55 PM
(516e) Dynamics and Drying-Induced Assembly of Shape-Anisotropic Nanoparticles
2:35 PM
(516g) Developing Data-Driven Methods to Enable Computationally Efficient First-Principles Kinetic Models in Nanoporous Catalysts

Topics 

Computational Molecular Engineering
Fundamentals (Chemical Engineering Theory)
Materials

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Individuals

AIChE Pro Members $150.00
AIChE Emeritus Members $105.00
AIChE Graduate Student Members Free
AIChE Undergraduate Student Members Free
AIChE Explorer Members $225.00
Non-Members $225.00

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