ACS Symposium Series - Transition State Modeling for Catalysis
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Published By American Chemical Society

0841236100, 0841217092
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Kinetic Theory and Transition State Simulation of Dynamics in Zeolites

1999 ◽  
pp. 296-306
Author(s):  
Chandra Saravanan ◽  
Fabien Jousse ◽  
Scott M. Auerbach
Keyword(s):  
Kinetic Theory ◽  
Transition State

Performance of Density Functional for Transition States

1999 ◽  
pp. 20-32 ◽  
Author(s):  
D. R. Salahub ◽  
S. Chrétien ◽  
A. Milet ◽  
E. I. Proynov
Keyword(s):  
Density Functional ◽  
Transition States

Reaction Mechanisms of Transition Metal Catalyzed Processes

1999 ◽  
pp. 114-127 ◽  
Author(s):  
Christian Boehme ◽  
Stefan Dapprich ◽  
Dirk Deubel ◽  
Ulrich Pidun ◽  
Martin Stahl ◽  
...  
Keyword(s):  
Transition Metal ◽  
Reaction Mechanisms ◽  
Transition Metal Catalyzed ◽  
Metal Catalyzed

Charge Transfer Interactions in Biology: A New View of the Protein-Water Interface

1999 ◽  
pp. 439-447 ◽  
Author(s):  
Gautham Nadig ◽  
Laura C. Van Zant ◽  
Steve L. Dixon ◽  
Kenneth M. Merz
Keyword(s):  
Charge Transfer ◽  
Water Interface ◽  
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