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


COMP		Tuesday, March 25, 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

Organizer, Presiding:	Kieron Burke
Organizer:	John McKelvey
8:30 AM	125	A dynamical approach to electron transport in molecular wires Roberto Car
9:20 AM	126	Spectroscopic calculations on transition-metal complexes using TDDFT and ab initio methods: Calibration and application to recent problems in bioinorganic chemistry Frank Neese
10:10 AM		Intermission
10:25 AM	127	Excited states and nonlinear optical response of conjugated molecules: A TDDFT study Sergei Tretiak
11:15 AM	128	Density-functional excited states through adiabatic connection perturbation theory Mel Levy

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