| PHYS | Tuesday, August 21, 2007 | ||
8:20 AM-11:55 AM BCEC -- 160C, Oral | |||
Computational Electrochemistry for New Energy | |||
| Materials and Processes | |||
| Organizers: | Michel Dupuis Donald G. Truhlar | ||
| Presiding: | James T. Muckerman | ||
| 8:20 AM | 203 | Bridging the gap between nanoparticles and extended surfaces in electrochemistry Timo Jacob, Matthias Scheffler, Theodore E. Madey | |
| 9:00 AM | 204 | Parameter free simulation of oxygen vacancies diffusion in yttrium stabilized zirconia Alessandro Curioni, Carlo Pignedoli, Wanda Andreoni | |
| 9:40 AM | 205 | Time-domain ab initio studies of photoinduced electron transfer in the dye-sensitized semiconductor solar cell Oleg V. Prezhdo, Walter R. Duncan | |
| 10:00 AM | Intermission | ||
| 10:15 AM | 206 | Oxygen activation at metal and metal oxide surfaces William F. Schneider, Rachel B. Getman, Hangyao Wang | |
| 10:55 AM | 207 | Non situ studies of the oxygen reduction reaction J. Will Medlin, Matthew P. Hyman | |
| 11:35 AM | 208 | Modeling electrochemistry with analytic density functional theory Brett I Dunlap | |
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Symposium Grid -- Division of Physical Chemistry -- Session Listing
The 234th ACS National Meeting, Boston, MA, August 19-23, 2007