Structure sensitivity of double bond isomerization of butene over MgO surfaces: A periodic DFT study

2011 ◽  
Vol 974 (1-3) ◽  
pp. 52-56 ◽  
Author(s):  
Chuan-Ming Wang ◽  
Yang-Dong Wang ◽  
Jing Dong ◽  
Su Liu ◽  
Zai-Ku Xie
Keyword(s):  
Double Bond ◽  
Structure Sensitivity ◽  
Dft Study ◽  
Double Bond Isomerization ◽  
Periodic Dft

scholarly journals DFT Study on Double-bond Isomerization of trans-2-butene Catalyzed by Zeolites

2005 ◽  
Vol 21 (08) ◽  
pp. 898-902
Author(s):  
LI Hui-ying ◽  
◽  
PU Min ◽  
CHEN Biao-hua
Keyword(s):  
Double Bond ◽  
Dft Study ◽  
Double Bond Isomerization

Mechanisms of Double-Bond Isomerization Reactions of n-Butene on Different Lewis Acids

ACS Catalysis ◽  
2021 ◽  
pp. 11293-11304
Author(s):  
Fengjiao Yi ◽  
Peng He ◽  
Huimin Chen ◽  
Yurong He ◽  
Zhichao Tao ◽  
...  
Keyword(s):  
Double Bond ◽  
Lewis Acids ◽  
Double Bond Isomerization

Understanding the Reactivity and Basicity of Zeolites: A Periodic DFT Study of the Disproportionation of N2O4 on Alkali-Cation-Exchanged Zeolite Y

2008 ◽  
Vol 14 (17) ◽  
pp. 5168-5177 ◽  
Author(s):  
Pierre Mignon ◽  
Evgeny A. Pidko ◽  
Rutger A. Van Santen ◽  
Paul Geerlings ◽  
Robert A. Schoonheydt
Keyword(s):  
Zeolite Y ◽  
Alkali Cation ◽  
Dft Study ◽  
Periodic Dft

Double bond isomerization of ethyl linoleate and vegetable oils to conjugated derivatives over an LDH supported ruthenium catalyst

RSC Advances ◽  
2015 ◽  
Vol 5 (45) ◽  
pp. 36075-36082 ◽  
Author(s):  
Sivashunmugam Sankaranarayanan ◽  
Gobi Selvam ◽  
Kannan Srinivasan
Keyword(s):  
Double Bond ◽  
Vegetable Oils ◽  
Ethyl Linoleate ◽  
Ruthenium Catalyst ◽  
Reaction Conditions ◽  
Double Bond Isomerization

Isomerization of ethyl linoleate and vegetable oils to conjugated derivatives is achieved over an MgAl-LDH supported ruthenium catalyst under mild reaction conditions.

9, 13-dicis-Rhodopsin and its one-photon-one-double-bond isomerization

Biochemistry ◽  
1988 ◽  
Vol 27 (17) ◽  
pp. 6495-6499 ◽  
Author(s):  
Yoshinori Shichida ◽  
Katsuki Nakamura ◽  
Toru Yoshizawa ◽  
Achla Trehan ◽  
Marlene Denny ◽  
...  
Keyword(s):  
Double Bond ◽  
Double Bond Isomerization

scholarly journals Acetylene and Ethylene Adsorption on a β-Mo2C(100) Surface: A Periodic DFT Study on the Role of C- and Mo-Terminations for Bonding and Hydrogenation Reactions

2017 ◽  
Vol 121 (36) ◽  
pp. 19786-19795 ◽  
Author(s):  
Carlos Jimenez-Orozco ◽  
Elizabeth Florez ◽  
Andres Moreno ◽  
Ping Liu ◽  
José A. Rodriguez
Keyword(s):  
Dft Study ◽  
Ethylene Adsorption ◽  
Hydrogenation Reactions ◽  
Periodic Dft

scholarly journals Periodic DFT Study of the Thermodynamic Properties and Stability of Schoepite and Metaschoepite Mineral Phases

2018 ◽  
Vol 3 (1) ◽  
pp. 17-28 ◽  
Author(s):  
Francisco Colmenero ◽  
Ana María Fernández ◽  
Joaquín Cobos ◽  
Vicente Timón
Keyword(s):  
Thermodynamic Properties ◽  
Dft Study ◽  
Mineral Phases ◽  
Periodic Dft
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