Classical Trajectory Studies of Gas Phase Reaction Dynamics and Kinetics Using Ab initio Potential Energy Surfaces

1989 ◽  
pp. 367-382 ◽  
Author(s):  
Richard L. Jaffe ◽  
Merle D. Pattengill ◽  
David W. Schwenke
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Gas Phase ◽  
Potential Energy Surfaces ◽  
Reaction Dynamics ◽  
Classical Trajectory ◽  
Phase Reaction ◽  
Gas Phase Reaction ◽  
Energy Surfaces

ChemInform Abstract: Synthesis of β-Lactams from Fluoroketenes and Imines: Ab initio Potential Energy Surfaces in Gas Phase and in Solution.

ChemInform ◽  
2010 ◽  
Vol 27 (40) ◽  
pp. no-no
Author(s):  
R. LOPEZ ◽  
M. F. RUIZ-LOPEZ ◽  
D. RINALDI ◽  
J. A. SORDO ◽  
T. L. SORDO
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Gas Phase ◽  
Potential Energy Surfaces ◽  
Energy Surfaces

Synthesis of β-Lactams from Fluoroketenes and Imines:  Ab Initio Potential Energy Surfaces in Gas Phase and in Solution

1996 ◽  
Vol 100 (25) ◽  
pp. 10600-10608 ◽  
Author(s):  
R. López ◽  
M. F. Ruiz-López ◽  
D. Rinaldi ◽  
J. A. Sordo ◽  
T. L. Sordo
Keyword(s):  
Potential Energy ◽  
Ab Initio ◽  
Gas Phase ◽  
Potential Energy Surfaces ◽  
Energy Surfaces
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