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