PHYSMonday, 11 September 2006

8:00 PM-10:00 PM Moscone Center -- Hall D, Sci-Mix
Sci-Mix
Organizer:Bruce D. Kay
 Anion photoelectron spectroscopy of carbon hydride clusters C2n+1H- (n=1-4)
Sean M. Sheehan, Bradley F Parsons, Giovanni Meloni, Nadine Wehres, Daniel M. Neumark
 Anomalous isotope effects in the O(1D) + CO2 isotope exchange reaction
Laurence Y. Yeung, John M. Eiler, Mitchio Okumura
 Coherent polyatomic dynamics studied by femtosecond time-resolved photoelectron spectroscopy: Photodissociation of CS2
Kenneth L Knappenberger Jr., Eliza Beth Lerch, Patrick Wen, Stephen R. Leone
 Construction and calibration of an instrument for 3D ion imaging
Konrad Koszinowski, Noah T. Goldberg, Andrew E. Pomerantz, Richard N. Zare
 Energy transfer and reactivity of vibrationally hot aromatic molecules with H2O
Daniel K. Havey, Qingnan Liu, Amy S. Mullin
 Gas phase photochemistry of carbon dioxide radical anion in water clusters
Terefe Habteyes, Luis Velarde, Andrei Sanov
 Influence of dissolved ions on interfacial reactions in salty glycerol
Jennifer L. DeZwaan, Annabel H. Muenter, Gil Nathanson
 IVR and VER at high state densities: Ultrafast transient absorption spectroscopy of vibrational overtones
Steven T. Shipman, Pamela L. Crum, Ellen L. Mierzejewski, Brooks H. Pate
 Photo-oxidation of indenylidene-dihydropyridine derivatives: Conical intersection manipulation by solvent polarity
Semyon Cogan, Yehuda Haas, Shmuel Zilberg
 Photodissociation of rhodamine ions in a quadrupole ion trap
Nicholas A. Sassin, Stephanie C. Everhart, Kent M. Ervin, Joseph I. Cline
 Photoionization and photoelectron spectroscopy of Rydberg states of diazomethane
Igor Fedorov, Lukasz Koziol, Jessica A. Parr, Guosheng Li, Anna I. Krylov, Hanna Reisler
 Probing the bimolecular product channels of O + C3H5 via unimolecular dissociation
Benjamin L. FitzPatrick, Kai-Chung Lau, Laurie J. Butler, Jim J. Lin
 Rotationally-resolved reactive scattering: imaging detailed Cl + C2H6 reaction dynamics
Cunshun Huang, Wen Li, Arthur G. Suits
 Structural dynamics of molecular rearrangement in the NO release from nitrobenzene determined by ultrafast electron diffraction
Yonggang He, Andreas Gahlmann, Jonathan S. Feenstra, Sang Tae Park, Ahmed H. Zewail
 UV excited electronic state decomposition of the energetic materials HMX and RDX using ns and fs laser spectroscopy
Margo Greenfield, Yuanqing Guo, Elliot R. Bernstein
 Vibrational relaxation of CpMn(CO)3
Jacob P. Schlegel, C. B. Harris
 A physics-based, coarse-grained model with orientation-dependent hydrogen bond potential for investigating protein folding
Eng Hui Yap, Nicolas Lux Fawzi, Teresa Head-Gordon
 Binary collision approximations for the memory function for density fluctuations in equilibrium atomic fluids
Joyce E. Noah, Hans C. Andersen
 Conical and glancing Jahn-Teller intersections in the cyclic trinitrogen cation
Vadim Mozhayskiy, Anna I. Krylov
 Energy flow in a trans-formanilide (TFA)-water complex and the kinetics of water shuttling
Johnson K Agbo, David M. Leitner, T. S. Zwier, Evgeniy M. Myshakin, Kenneth D. Jordan
 Formation and relaxation of excited states in solution: A new time dependent polarizable continuum model based on time-dependent density functional theory
Marco Caricato, Benedetta Mennucci, Jacopo Tomasi, Francesca Ingrosso, Roberto Cammi, Stefano Corni, Giovanni Scalmani
 Photoelectron spectroscopic and ab initio theoretical study of planar nitrogen doped aluminum clusters Al3N-, Al4N-, and Al5N-
Boris Averkiev, Alexander I. Boldyrev, Xi Li, Lai-Sheng Wang
 Specific rotation of amino acids: A new look at an old rule
Matthew D. Kundrat, Jochen Autschbach
 The unrestricted imperfect pairing method
Keith V. Lawler Jr., Martin Head-Gordon
 Theoretical study of CHCl3 + OH-(H2O)n → CH(OH)Cl2 +Cl-(H2O)n, n=0-2 reactions
Ming-Kang Tsai, Gregory K Schenter, Bruce C. Garrett
 Time correlation functions using the Semiclassical Initial Value Representation
Charulatha Venkataraman, William H. Miller
 Towards computational modeling of chromatin: All-atom MD simulations of counterion condensation around DNA
Alex Savelyev, Garegin A. Papoian
 OH formation in the reaction of acetyl radical with O2: Ab initio and RRKM reaction mechanism study
Andrea Maranzana, Glauco Tonachini, John R. Barker
 Role of vibrational dynamics in electronic transitions in an intense laser field
Patrick J. Nichols, Mark R. Hoffmann
 Surface interactions of graphitic sheets and water: A study of the hydrophobic effect
Estelle M. Huff, Peter Pulay
 Cation transport by redox-active synthetic ion channels
Cristina Suárez, Adam C. Hall, C. Dennis Hall, Anu Maharjan, Angela Saquibal
 Dynamics of unbinding of cell adhesion molecules: Transition from catch to slip bonds
Valeri Barsegov, Devarajan Thirumalai
 Fluorescence-detected circular dichroism and circularly-polarized luminescence of a single molecule
Ruthanne Hassey, Ellen J. Swain, Nathan I. Hammer, Emily L. Richards, D. Venkataraman, Michael D. Barnes
 Investigating membrane heterogeneities with fluorescence energy transfer
Kevin B. Towles, Nily Dan
 Molecular dynamics study of anysotropic solvation of membrane bound proteins
Sui Shen, Madhusoodanan Mottamal, Goran Krilov
 Single molecule study of DNA polymerization by HIV-1 reverse transcriptase
Sangjin Kim, Charles Schroeder, Paul C. Blainey, X. Sunney Xie
 Biophysical studies on polymer-sandwiched lipid bilayers
Sumit Garg, Jay X. Tang, Christoph A Naumann, Juergen Ruehe
 Atomic-force-studies of the Porin MspA from M. smegmatis on mica and gold surfaces
Stefan H. Bossmann, Matthew Basel, Michael Niederweis
 Survival of bacterial spores in extreme environments: Validation and application of a novel endospore viability assay
Pun To Yung, Hannah S. Shafaat, Stephanie A. Connon, Wanwan Yang, Elizabeth D. Lester, Adrian Ponce
 Effect of solution pH on SOPC membrane mechanics and dipole potential
Yong Zhou, Robert M. Raphael
 Studies of exocytotic membrane fusion by single molecule FRET and single molecule fluorescence images
Marcelle Koenig, Suren Felekyan, Ralf Kuehnemuth, Christina Schuette, Jerker Widengren, Reinhard Jahn, Claus A. M. Seidel
 Suppressing Brownian motion of individual molecules in solution
Adam Cohen, W. E. Moerner
 Betalain pigments for solar energy conversion in dye-sensitized TiO2 films
Dongshe Zhang, Suzanne M. Lanier, Jason L. Avent, Jonathan A. Downing, Jeanne L. McHale
 Chemically selective imaging with single pulse CARS microscopy
Allison G. Caster, Sang-Hyun Lim, Olivier Nicolet, Stephen R. Leone
 DNA templated Ag nanocluster formation
Caroline M. Ritchie, Spence T. Gibbs, John R. Kiser, Robert M. Dickson, Jeffrey T. Petty
 Effect of interparticle coupling on coherent phonon oscillations of monolayer periodic plasmonic nanoparticles
Wenyu Huang, Wei Qian, Mostafa A. El-Sayed
 Halide free synthesis of energetic azolium azolate salts
Marcin Smiglak, David Drab, C. Corey Hines, W. Matthew Reichert, Robin D. Rogers, Kostyantyn Kirichenko, Adam Vincek
 Paper Withdrawn
 Intervalence charge transfer in hybrid organic-inorganic neutral radicals
Lisa N. Perlson, Imma Ratera, Christian Sporer, Jaume Veciana, Steven G. Boxer
 Plasmon resonances in Au-Ag nanoboxes studied by single nanoparticle spectroscopy
Min Hu, Gregory V. Hartland, Jingyi Chen, Zhi-Yuan Li, Younan Xia, Xingde Li, Manuel Marquez
 Surface-enhanced Raman spectroscopic monitoring of the catalytic oxidation of 4-(dimethylamino)benzaldehyde by gold nanoparticles
Rachel M. Krieger, Paul W. Jagodzinski
 Use of classical adsorption models for description of methane adsorption under ambient temperature
Wei Xing, Xiaodong Dai, Zi-feng Yan
 Colloidal crystallization of polymer-grafted nanoparticles in ionic liquids
Kazuhide Ueno, Masayoshi Watanabe
 Temperature independence of orbital mediated tunneling in cobalt(II) phthalocyanine
KW. Hipps, Brett Gyarfas
 Crystal engineering utilizing ionic liquids
C. Corey Hines, Marcin Smiglak, W. Matthew Reichert, Scott T. Griffin, Robin D. Rogers
 Exciton transfer in organic-semiconductor nanostructures
Dmitri S. Kilin, Kiril Tsemekhman, Eduard I. Zenkevich, Svetlana V. Kilina
 Assessment of SC-alpha functional for the computation of transition state
Yi-Lei Zhao, Thomas C. Allison, Carlos A. Gonzŕlez, Chiao-Yang Hsiao, Manuel Marquez
 Exploring excited states' potential energy surfaces and conical intersections in DNA bases
Evgeny Epifanovsky, Anna I. Krylov
 Ion current calculations based on kinetic lattice grand canonical Monte Carlo simulations for a cyclic peptide nanotube
Hyonseok Hwang, George C. Schatz, Mark A. Ratner
 Phonon-induced relaxation in PbSe quantum dots
Svetlana V. Kilina, Oleg V. Prezhdo
 Quantum chemical studies of a carbon acid catalyst in Friedel-Crafts acylation reactions
Katie R. Mitchell-Koch, Mikhail V. Barybin, Ward H. Thompson
 Si(100): When glycine attacks
Jonathan M. Mullin, Dorit Shemesh, R. Benny Gerber, M. S. Gordon
 Simulation study of the collapse of Langmuir monolayers
Christian D. Lorenz, Alex Travesset, David Vaknin, Wei Bu
 Theory of the statistics of kinetic transitions
Irina Gopich, Attila Szabo
 Assessment and application of the Koopmans' Theorem generalized Mulliken-Hush approach
Robert J. Cave, Stephen Edwards, W. Kurlancheek, Elaine K. Hart, J. Andrew Kouzelos
 Accurate computation of fluorescence spectra in solution: A time-dependent DFT study on the excited states of some uracil derivatives in water and acetonitrile solution
Roberto Improta, Vincenzo Barone, Michael Frisch, Giovanni Scalmani, Thomas Gustavsson
 Thermal electron reactions and RRKM theory
Edward C. M. Chen, Edward S. Chen, Mark Sabaugh, Winston Chang

Symposium Grid -- Division of Physical Chemistry -- Session Listing

The 232nd ACS National Meeting, San Francisco, CA, September 10-14, 2006