Session: Recent Developments and Applications of Time-Dependent DFT and Related Ab Initio and Semiempirical Methods


COMP		Wednesday, March 26, 2003

8:30 AM-12:05 PM Convention Center -- Room 268,Oral
Recent Developments and Applications of Time-Dependent DFT and Related Ab Initio and Semiempirical Methods

Presiding:	Sergei Tretiak
Organizers:	Kieron Burke John McKelvey
8:30 AM	283	Excited-state structure of nucleobases and exciton delocalization in DNA John M. Jean
9:20 AM	284	TDDFT calculations on electronically excited states in mono- and binuclear transition-metal complexes containing N, O, or S donor atoms Karsten Krogh-Jespersen
10:10 AM		Intermission
10:25 AM	285	Current density-functional theory for the optical response of solids Neepa T. Maitra, Kieron Burke
11:15 AM	286	Using all-singles CI and random phase approximations in studies of light absorption of large conjugated systems for PPP and INDO/S methods John M. McKelvey, Sergei Tretiak, Stefan Grimme

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