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Molecular Simulation of Adsorption II
Chair(s):
Ravikovitch, P. I., ExxonMobil Research and Engineering
Co-chair(s):
Lin, L. C., The Ohio State University

his session presents the most recent advances in the molecular simulations of adsorbents, adsorption phenomena, molecular recognition, adsorption properties and parameters, and mass transfer kinetics and properties.

Papers:
8:00 AM
(682a) Insights and Rational Design of Metal-Organic Frameworks for Enantiomers Separations
8:17 AM
(682b) Selective Carbohydrate Adsorption in Solvated Nu-1000
8:34 AM
(682c) Molecular Simulation of Combined Chemi- and Physi-Sorption of Carbon Monoxide on Cobalt in the Presence of Supercritical Hexane
8:51 AM
(682d) Atomistic Understandings of the CO2 Uptake Difference in Photo Responsive Metal-Organic Frameworks
9:08 AM
(682e) Sorption-Relaxation Behavior in Polymers of Intrinsic Microporisity during Gas Separation from Molecular Simulations
9:25 AM
(682f) Framework Flexibility Driven Adsorptive Separation of C8 Aromatic Isomers in Metal Organic Frameworks: A Computational Exploration
9:42 AM
(682g) Molecular Simulation Studies Probing Transport and Adsorption of C8 Aromatics through MFI Nanosheet Membranes
9:59 AM
(682h) Computational Screening of Zeolites for Gas Separation Applications from Multi-Component Mixtures
10:16 AM
(682i) Unraveling of Pristine and Defective Metal-Organic Framework (MOF) Structures through Molecular Simulation
Topics: 
Adsorption

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Individuals

AIChE Members $150.00
AIChE Graduate Student Members Free
AIChE Undergraduate Student Members Free
Non-Members $225.00