Competition of Secondary versus Tertiary Carbenium Routes for the Type B Isomerization of Alkenes over Acid Zeolites Quantified by Ab Initio Molecular Dynamics Simulations-Reference-Cited by-同舟云学术

Competition of Secondary versus Tertiary Carbenium Routes for the Type B Isomerization of Alkenes over Acid Zeolites Quantified by Ab Initio Molecular Dynamics Simulations

Published:2019-09-18 Issue:11 Volume:9 Page:9813-9828
ISSN:2155-5435
Container-title:ACS Catalysis
language:en
Short-container-title:ACS Catal.

Author:

Rey Jérôme¹,Raybaud Pascal¹^ORCID,Chizallet Céline¹^ORCID,Bučko Tomáš²³

Affiliation:

1. IFP Energies Nouvelles, Rond-Point de l’Echangeur de Solaize−BP 3, 69360 Solaize, France

2. Department of Physical and Theoretical Chemistry, Faculty of Natural Sciences, Comenius University in Bratislava, Ilkovičova 6, SK- 84215 Bratislava, Slovakia

3. Institute of Inorganic Chemistry, Slovak Academy of Sciences, Dúbravská cesta 9, SK-84236 Bratislava, Slovakia

Funder

IFP Energies Nouvelles

Vedeck? Grantov? Agent?ra M?VVa? SR a SAV

Agent?ra na Podporu V?skumu a V?voja

Publisher

American Chemical Society (ACS)

Subject

Catalysis,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acscatal.9b02856

Reference79 articles.