Molecular Simulation of Adsorption II

Monday, November 8, 2010: 3:15 PM
250 A Room (Salt Palace Convention Center)

Description:
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.


Sponsor:
Adsorption and Ion Exchange
Co-Sponsor(s):
Computational Molecular Science and Engineering Forum (21)


Chair:
Alexander V. Neimark
Email: aneimark@Rutgers.edu

Co-Chair:
Peter I. Ravikovitch
Email: peter.ravikovitch@exxonmobil.com

- indicates paper has an Extended Abstract file available on CD.







4:27 PM
(159e) Densitiy Funtional Theory Study of CO2 Sequestration On Magnesium-Based Adsorbents
Soonchul Kwon, Wangro Lee, Ji Il Choi, Seung Geol Lee and Seung Soon Jang

File available
4:45 PM
(159f) Atomic-Level Modeling of Separation CO2 Using Metal-Organic Framework Membranes
Jin-Chen Liu, De-Li Chen, Abraham C. Stern, Karl Johnson and Brian Space


See more of this Group/Topical: Separations Division