Unimolecular Decomposition of Ethyl Hydroperoxide: Ab Initio/Rice−Ramsperger−Kassel−Marcus Theoretical Prediction of Rate Constants

2011 ◽  
Vol 115 (5) ◽  
pp. 602-611 ◽  
Author(s):  
Dongna Chen ◽  
Hanfeng Jin ◽  
Zhandong Wang ◽  
Lidong Zhang ◽  
Fei Qi
Keyword(s):  
Theoretical Prediction ◽  
Ab Initio ◽  
Rate Constants ◽  
Unimolecular Decomposition

scholarly journals Ab Initio Calculation of Rate Constants for Molecule-Surface Reactions with Chemical Accuracy

2016 ◽  
Vol 128 (17) ◽  
pp. 5321-5323 ◽  
Author(s):  
GiovanniMaria Piccini ◽  
Maristella Alessio ◽  
Joachim Sauer
Keyword(s):  
Ab Initio ◽  
Rate Constants ◽  
Ab Initio Calculation ◽  
Surface Reactions ◽  
Molecule Surface

Unimolecular decomposition of chemically activated triplet C4HD3 complexes: A combined crossed-beam and ab initio study

2001 ◽  
Vol 115 (11) ◽  
pp. 5117-5125 ◽  
Author(s):  
R. I. Kaiser ◽  
A. M. Mebel ◽  
Y. T. Lee ◽  
A. H. H. Chang
Keyword(s):  
Ab Initio ◽  
Ab Initio Study ◽  
Unimolecular Decomposition
Sign in / Sign up

Export Citation Format

Share Document