Mechanistic Investigation on 1,5- to 2,6-Dimethylnaphthalene Isomerization Catalyzed by Acidic β Zeolite: ONIOM Study with an M06-L Functional-Reference-Cited by-同舟云学术

Mechanistic Investigation on 1,5- to 2,6-Dimethylnaphthalene Isomerization Catalyzed by Acidic β Zeolite: ONIOM Study with an M06-L Functional

Published:2009-08-17 Issue:36 Volume:113 Page:16128-16137
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Kumsapaya Chawanwit¹,Bobuatong Karan¹,Khongpracha Pipat¹,Tantirungrotechai Yuthana¹,Limtrakul Jumras¹

Affiliation:

1. Laboratory for Computational and Applied Chemistry, Chemistry Department, Faculty of Science, Kasetsart University, Bangkok 10900, NANOTEC Center of Excellence, National Nanotechnology Center (NANOTEC), Kasetsart University Research and Development Institute, Bangkok 10900, and NANOTEC, National Science and Technology Development Agency, Khongluang, Pathumthani 12120, Thailand

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

https://pubs.acs.org/doi/pdf/10.1021/jp904098t

Reference52 articles.

1. Synthesis of 2,6-dimethylnaphthalene by methylation of methylnaphthalene on various medium and large-pore zeolite catalysts

2. Production of dimethyl-2,6-naphthalenedicarboxylate: precursor to polyethylene naphthalate

3. Industrial application of solid acid–base catalysts

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