COMPTuesday, August 21, 2007

9:00 AM-12:10 PM BCEC -- 160B, Oral
Bold Predictions in Theoretical Chemistry: A Symposium in Honor of One of the Boldest, Bill Goddard, on the Occasion of his 70th Birthday
Theory
Organizers:Emily A. Carter
Mark S. Gordon
Presiding:Richard P Muller
9:00 AMReading the map while walking through the minefield: An ab initio excursion into high temperature superconductivity
Jamil Tahir-Kheli, William A Goddard III
9:35 AMRecent advances and ongoing challenges in accelerated molecular dynamics methods
Arthur F. Voter
10:10 AMHypervalency in molecules
Thom H. Dunning Jr., David E. Woon
10:45 AMIntermission
11:00 AMA general approach to intermolecular interactions
Mark S. Gordon
11:35 AMRevisiting the concepts of chemical bond, resonance and hyperconjugation
Marco A C Nascimento, Felipe P Fleming, André G H Barbosa

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Symposium Grid -- Division of Computers in Chemistry -- Session Listing

The 234th ACS National Meeting, Boston, MA, August 19-23, 2007