Decomposition of Anthranil. Single Pulse Shock-Tube Experiments, Potential Energy Surfaces and Multiwell Transition-State Calculations. The Role of Intersystem Crossing†

2006 ◽  
Vol 110 (27) ◽  
pp. 8248-8258 ◽  
Author(s):  
Assa Lifshitz ◽  
Carmen Tamburu ◽  
Aya Suslensky ◽  
Faina Dubnikova
Keyword(s):  
Potential Energy ◽  
Transition State ◽  
Shock Tube ◽  
Potential Energy Surfaces ◽  
Single Pulse ◽  
Intersystem Crossing ◽  
Energy Surfaces

Exploring the potential energy surfaces of association of NO with aminoacids and related organic functional groups: the role of entropy of association

2007 ◽  
Vol 118 (3) ◽  
pp. 649-663 ◽  
Author(s):  
Rachel Crespo-Otero ◽  
Yoana Pérez-Badell ◽  
Juan Alexander Padrón-García ◽  
Luis Alberto Montero-Cabrera
Keyword(s):  
Potential Energy ◽  
Functional Groups ◽  
Potential Energy Surfaces ◽  
Organic Functional Groups ◽  
Energy Surfaces

Dynamics of X+CH4 (X=H,O,Cl) reactions: How reliable is transition state theory for fine-tuning potential energy surfaces?

2006 ◽  
Vol 125 (6) ◽  
pp. 064312 ◽  
Author(s):  
A. J. C. Varandas ◽  
P. J. S. B. Caridade ◽  
J. Z. H. Zhang ◽  
Q. Cui ◽  
K. L. Han
Keyword(s):  
Potential Energy ◽  
Transition State ◽  
Potential Energy Surfaces ◽  
Transition State Theory ◽  
State Theory ◽  
Fine Tuning ◽  
Energy Surfaces
Sign in / Sign up

Export Citation Format

Share Document