Molecular Simulation of Adsorption I

  • Conference: AIChE Annual Meeting
  • Year: 2011
  • Proceeding: 2011 Annual Meeting
  • Group:
    Separations Division
  • Type:
    Oral
  • Room:
    205 B
  • Location:
    Minneapolis Convention Center
  • Time:
    Tuesday, October 18, 2011 - 8:30am-11:00am
Chair(s):
Neimark, A. V., Rutgers University
Co-chair(s):
Siderius, D. W., National Institute of Standards and Technology (NIST)

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.

Papers:
8:30 AM
(242a) Use of the Transition Matrix Monte Carlo Simulation Method to Study Metastability and Phase Transitions In Gas Adsorption Processes
8:50 AM
(242b) Understanding Adsorption Hysteresis In Porous Silicon
9:10 AM
(242c) Monte-Carlo Simulation of the Capillary Condensation Hysteresis In Overlapping Spherical Cavities
9:30 AM
(242d) Adsorption of CO2 Using Amine Functionalized Silica
9:50 AM
(242e) Simulated and Experimental Adsorption Equilibria of Light Alkanes In MIL-53(Al) Metal-Organic Framework
10:10 AM
(242f) High Pressure Effects In Nanopores
10:30 AM
(242g) Sensitivity of Adsorption Isotherms to Minor Differences In Zeolite Structures: A Computational Investigation
Topics: 
Adsorption
Nanotechnology
Separations
Thermodynamics

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Individuals

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