PHYSMonday, April 7, 2008

1:20 PM-5:20 PM Morial Convention Center -- Rm. 345, Oral
Electronic Structure and Reaction Dynamics of Open-shell Species
Open-shell Species in Clusters and Condensed Phase
Organizers:Jingsong Zhang
Martin Head-Gordon
Presiding:Mitchio Okumura
1:20 PMSolvation and reactivity of the aqueous hydroxyl radical
Christopher Adriaanse, Marialore Sulpizi, Joost VandeVondele, Michiel Sprik
2:00 PMComplications in modeling the reaction dynamics of free radicals in solution phase
Robert W. Ashcraft, William H. Green Jr.
2:40 PMDynamics and spectroscopy of open-shell species in water: The ionization process
Christopher G. Elles, Christopher A. Rivera, Stephen E. Bradforth
3:00 PMIntermission
3:20 PMEmission from electronically excited metal atoms and exciplexes during single-bubble sonoluminescence
David J. Flannigan, Kenneth S. Suslick
3:40 PMCharacterization of open shell anion and cation cluster ions: Reaction intermediates and high energy isomers
Mark Johnson
4:20 PMAdjusting the knobs on hydrated-electron pseudopotentials
John M. Herbert
5:00 PMStudies of H atom and free radical reactions using unconventional spectroscopic methods
Khashayar Ghandi

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The 235th ACS National Meeting, New Orleans, LA, April 6-10, 2008