Variational Transition State Theory and Tunneling Calculations with Reorientation of the Generalized Transition States for Methyl Cation Transfer

1998 ◽  
Vol 102 (19) ◽  
pp. 3420-3428 ◽  
Author(s):  
Angels González-Lafont ◽  
Jordi Villà ◽  
José M. Lluch ◽  
Juan Bertrán ◽  
Rozeanne Steckler ◽  
...  
Keyword(s):  
Transition State ◽  
Transition State Theory ◽  
Transition States ◽  
State Theory ◽  
Variational Transition State Theory ◽  
Variational Transition State ◽  
Methyl Cation

scholarly journals Nanodusty plasma chemistry: a mechanistic and variational transition state theory study of the initial steps of silyl anion–silane and silylene anion–silane polymerization reactions

2015 ◽  
Vol 17 (24) ◽  
pp. 15928-15935 ◽  
Author(s):  
Junwei Lucas Bao ◽  
Prasenjit Seal ◽  
Donald G. Truhlar
Keyword(s):  
Transition State ◽  
Reaction Mechanisms ◽  
Transition State Theory ◽  
Plasma Chemistry ◽  
State Theory ◽  
Variational Transition State Theory ◽  
Variational Transition State

The aim of the present work is to understand the detailed reaction mechanisms in the growth of nanodusty particles, which is critical in plasma chemistry, physics and engineering.

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