2023 AIChE Annual Meeting

Session: Thermodynamics at the Nanoscale

Chair

Utkarsh Kapoor, Oklahoma State University

Co-Chairs

Nathan Mahynski, National Institute of Standards & Technology
Sriramvignesh Mani, The University of Chicago

Presentations

08:00 AM

(501a) Structure Optimized Potential Refinement: Pair Potentials from Experimental Scattering Data for Molecular Fluids
Abdur Rahman Shazed, Michael P. Hoepfner

08:18 AM

(501b) Impact of Liquid Structure on Thermodynamics and Kinetics of Chemical Reactions: Experimental and Molecular Simulations Demonstration with Acid Gas Absorption.
Frederick de Meyer, Eric Cloarec, Xavier Rozanska, Christophe Coquelet

08:36 AM

(501c) Novel Experimental Technique for the Study of Knudsen Diffusion in Complex Pore Geometries
Maria Mourkou, Marc-Olivier Coppens

08:54 AM

(501d) Selective Enhancement of Water Evaporation from Salt Solutions Using Graphene Nanopores: A Potential Eco-Friendly Approach for Desalination Applications
Anshaj Ronghe, K Ganapathy Ayappa

09:12 AM

(501e) Leveraging Non-Ideal Behavior in Binary Ionic-Liquid Mixtures to Design Efficient Electrolytes
Jindal Shah, Rohan Sartape, Amey Thorat, Rohit Chauhan, Meenesh R Singh

09:30 AM

(501f) Theoretical Investigation of the Binding of 1-Hexyl-3-Methylimidazolium Based Ionic Liquids with Iron Porphyrin
Sudip Kumar Das, Jindal Shah

09:48 AM

(501g) Chemical Warfare Agent Hydrolysis in the Nu-1000 Zr-MOF: Structure, Topology, and the Impact of Humidity
Liangliang Huang, Madeleine Oliver

10:06 AM

(501h) Thermodynamics of Anionic Iodine Species Under Interlayer-Confinement in Layered Double Hydroxides
Di Wu, Megan Hawkins, Hui Sun, Xianghui Zhang, Cody B. Cockreham, Hongwu Xu, Su Ha, Ellis Hammond-Pereira, Steven Saunders, Xiaofeng Guo