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Proceedings
2011 Annual Meeting
Separations Division
Molecular Simulation of Adsorption II
2011 Annual Meeting
Session: Molecular Simulation of Adsorption II
Co-Chair
Daniel W. Siderius
, National Institute of Standards and Technology (NIST)
Presentations
03:15 PM
(392a) Heterogeneous Cavitation of Metastable Nitrogen In Spherical Pores with Non-Wetting Defects
Christopher J. Rasmussen, Gennady Gor, Alexander V. Neimark
03:35 PM
(392b) Molecular Screening of Alcohol Adsorption Onto Zeolite From Aqueous Solution
03:55 PM
(392c) Dynamic Mean Field Theory for Mixtures Confined In Porous Materials
John Edison, Peter A. Monson
04:15 PM
(392d) Adsorption of CO2 In a Spin-Crossover Metal Coordination Polymer
Jinchen Liu, Jeffery Culp, Karl Johnson
04:35 PM
(392e) Supercritical CO2 Adsorption In Micro- and Mesoporous Carbon
Yangyang Liu, Ronny Pini
04:55 PM
(392f) Cation-Exchanged Zeolites As the Adsorbent for H2S: Quantum Chemical Calculations
Chun-Yi Sung, Matteo Cococcion
05:15 PM
(392g) A Reactive Molecular Dynamics Simulation of Hydrogen Sulfide Dissociation Over Graphene Oxide
Keith E. Gubbins