DFT Study of Hydride Exchange in a Binuclear Ruthenium Complex

2007 ◽  
Vol 26 (1) ◽  
pp. 56-64 ◽  
Author(s):  
Samat Tussupbayev ◽  
Sergei F. Vyboishchikov
Keyword(s):  
Ruthenium Complex ◽  
Dft Study

Density functional investigations on the catalytic cycle of the hydrogenation of aldehydes catalyzed by an enhanced ruthenium complex: an alcohol-bridged autocatalytic process

RSC Advances ◽  
2015 ◽  
Vol 5 (4) ◽  
pp. 2827-2836 ◽  
Author(s):  
Xi Lu ◽  
Qian Liu ◽  
Xiaoyin Wang ◽  
Runjiao Cheng ◽  
Mingtao Zhang ◽  
...  
Keyword(s):  
Density Functional ◽  
Ruthenium Complex ◽  
Catalytic Cycle ◽  
Dft Study ◽  
Ru Complex ◽  
Autocatalytic Process

A DFT study of the catalytic cycle of PhCHO hydrogenation catalyzed by Casey’s Ru-complex.

Catalytic Mechanism for the Ruthenium-Complex-Catalyzed Synthesis of Amides from Alcohols and Amines: A DFT Study

2013 ◽  
Vol 32 (16) ◽  
pp. 4571-4576 ◽  
Author(s):  
Daeheum Cho ◽  
Kyoung Chul Ko ◽  
Jin Yong Lee
Keyword(s):  
Catalytic Mechanism ◽  
Ruthenium Complex ◽  
Dft Study

DFT study of the effect of hidrocarbonated chains on the electronic properties of some oligothiophene derivatives

2009 ◽  
Author(s):  
Manuel Fernández-Gómez ◽  
Amparo Navarro ◽  
MªPaz Fernández-Liencres ◽  
Mónica Moral ◽  
José Manuel Granadino-Roldán ◽  
...  
Keyword(s):  
Electronic Properties ◽  
Dft Study
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