Location and Conformation of n-Alkanes in Zeolites: An Analysis of Configurational-Bias Monte Carlo Calculations-Reference-Cited by-同舟云学术

Location and Conformation of n-Alkanes in Zeolites: An Analysis of Configurational-Bias Monte Carlo Calculations

Published:1996-01-01 Issue:44 Volume:100 Page:17573-17581
ISSN:0022-3654
Container-title:The Journal of Physical Chemistry
language:en
Short-container-title:J. Phys. Chem.

Author:

Bates Simon P.¹,van Well Willy J. M.¹,van Santen Rutger A.¹,Smit Berend²

Affiliation:

1. Schuit Institute of Catalysis, Laboratory for Inorganic Chemistry & Catalysis, Eindhoven University of Technology, P.O. Box 513, 5600 MB Eindhoven, The Netherlands

2. Shell International Oil Products, B.V. Shell Research and Technology Centre, Amsterdam P.O. Box 38000, 1030 BN Amsterdam, The Netherlands

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,General Engineering

Link

https://pubs.acs.org/doi/pdf/10.1021/jp961386w

Reference21 articles.

1. Simulation studies of the structure and energetics of sorbed molecules in high-silica zeolites. 1. Hydrocarbons

2. Molecular dynamics simulations of sustained oscillations in a thermochemical system

3. Molecular dynamics simulation of propane and methane in silicalite

4. Computer Simulations of the Energetics and Siting of n-Alkanes in Zeolites

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