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International Academy of Quantum Molecular Science Award, 1978; 
Bourke Lectureship, Royal Society of Chemistry, U.K., 1990; 
Chemical Society Award, The Chemical Society of Japan, 1992; 
Schrodinger Medal, The World Association of Theoretical Organic Chemists, 1993; 
International Academy of Quantum Molecular Science, Member and President (2000-2003); 
World Association of Theoretically Oriented Chemists, Fellow.




�u�t�F�@�@Professor Keiji Morokuma
          Cherry L. Emerson Center for Scientific Computation and
          Department of Chemistry, Emory University

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�@�@�@�@�iComputational Study of Chemical Reactions. From Elementary Chemical
�@�@�@�@�@Reactions, Transition Metal Catalyses to Mechanism of Fullerene �@�@�@
�@�@�@�@�@Formation�@Reaction�j

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�v�|�FChemical reaction is the central theme of research in chemistry, and
computational studies of potential energy surfaces can provide new insight
into the mechanism, rate and dynamics of chemical reactions. In the present
seminar, I will discuss some of our recent studies on potential energy
surfaces and dynamics of a variety of molecular systems, including 


1. photodissociation and ion molecule reactions of small gas phase 
   molecules cascading through multiple potential energy surfaces

2. classical molecular dynamics study of formation of fullerenes 
   from C2 fragments

3. potential energy surfaces and mechanisms of reactions of transition 
   metal complexes

4. structure and reactions of metalloenzymes including the effects of 
   protein environments.