Molecular Simulation of Adsorption II | AIChE

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Molecular Simulation of Adsorption II

Chair(s)

Ravikovitch, P., ExxonMobil Research and Engineering

Co-chair(s)

This 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.

Presentations

8:30 AM
(483a) Polymer adsorption in nanopores and nanoporous substrates
8:51 AM
(483b) Adsorption-Induced Surface Stresses Based on Electronic Structure DFT Calculations
9:12 AM
(483c) Large-Scale Topologically-Guided Design of Metal-Organic Frameworks and Application to Cryo-Adsorbed Hydrogen Storage
9:33 AM
(483d) Adsorptive Separation of Xylene Isomers Using Zn2(BDC)2(DABCO) [MOF1] Metal Organic Framework
9:54 AM
(483e) Temperature and Loading-Dependent Diffusion of Light Hydrocarbons in ZIF-8 As Predicted through Fully Flexible Molecular Simulations
10:15 AM
(483g) Hydrogen Isotope Separation By Carbonaceous Materials

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Pricing

Individuals

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

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