Effects of the Zeolite Framework on the Adsorptions and Hydrogen-Exchange Reactions of Unsaturated Aliphatic, Aromatic, and Heterocyclic Compounds in ZSM-5 Zeolite: A Combination of Perturbation Theory (MP2) and a Newly Developed Density Functional Theory (M06-2X) in ONIOM Scheme-Reference-Cited by-同舟云学术

Effects of the Zeolite Framework on the Adsorptions and Hydrogen-Exchange Reactions of Unsaturated Aliphatic, Aromatic, and Heterocyclic Compounds in ZSM-5 Zeolite: A Combination of Perturbation Theory (MP2) and a Newly Developed Density Functional Theory (M06-2X) in ONIOM Scheme

Published:2009-07-28 Issue:22 Volume:25 Page:12990-12999
ISSN:0743-7463
Container-title:Langmuir
language:en
Short-container-title:Langmuir

Author:

Boekfa Bundet¹²³,Choomwattana Saowapak¹²³,Khongpracha Pipat¹²³,Limtrakul Jumras¹²³

Affiliation:

1. Laboratory for Computational and Applied Chemistry, Chemistry Department, Faculty of Science, Kasetsart University, Bangkok 10900, Thailand

2. Center of Nanotechnology, Kasetsart University Research and Development Institute, Kasetsart University, Bangkok 10900, Thailand

3. NANOTEC Center of Excellence, National Nanotechnology Center, Bangkok 10900, Thailand

Publisher

American Chemical Society (ACS)

Subject

Electrochemistry,Spectroscopy,Surfaces and Interfaces,Condensed Matter Physics,General Materials Science

Link

https://pubs.acs.org/doi/pdf/10.1021/la901841w

Reference53 articles.

1. Towards a molecular understanding of shape selectivity

2. A Link between Reactivity and Local Structure in Acid Catalysis on Zeolites

3. Understanding Methane Aromatization on a Zn-Modified High-Silica Zeolite

4. State of the art and future challenges of zeolites as catalysts

5. Shape-Selective Oligomerization of Alkenes to Near-Linear Hydrocarbons by Zeolite Catalysis

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