Journal of Physical Chemistry, 2002, V 106, N 25, June 27.
FEATURE ARTICLE
State-Selected and State-to-State Ion-Molecule Reaction Dynamics
Cheuk-Yiu Ng
pp 5953 - 5966 
ARTICLES
DYNAMICS AND RELAXATION
Proton-Transfer Tautomerism in 10-Hydroxybenzo[h]quinolines: Heavy Atom Effects 
and Non-Hydrogen-Bonded Photorotamer Formation in 77 K Glassy Matrixes
Pi-Tai Chou, Guo-Ray Wu, Yun-I Liu, Wei-Shan Yu, and Chau-Shuen Chiou
pp 5967 - 5973 
Subpicosecond Kinetic Polarization Spectroscopic Study of the Complex 
Photophysical Behavior of Solutions of 9,9'-Bianthryl
Erik J. A. de Bekker, Audrius Pugzlys, and Cyril A. G. O. Varma
pp 5974 - 5988 
Electron Transfer from Triethylamine to the Triplet State of 
Dinitronaphthalenes, 4,4'-Dinitrobiphenyl and 2,7-Dinitrofluorenone: Time 
Resolved UV-Vis Spectroscopic and Conductometric Study in Polar Solvents
Helmut G?rner
pp 5989 - 5998 
Ultrafast Study of the Photodissociation of Bromoiodomethane in Acetonitrile 
upon 266 nm Excitation
Alexander N. Tarnovsky, Magnus Wall, Magnus Gustafsson, Noelle Lascoux,
Villy Sundstr?m, and Eva ?kesson
pp 5999 - 6005 
Surface Jumping: Franck-Condon Factors and Condon Points in Phase Space
S. Kallush, Bilha Segev, A. V. Sergeev, and E. J. Heller
pp 6006 - 6016 
Solvation Dynamics in the Water Pool of Aerosol Sodium Dioctylsulfosuccinate 
Microemulsion: Effect of Polymer
Sobhan Sen, Partha Dutta, Dipankar Sukul, and Kankan Bhattacharyya
pp 6017 - 6023 
High-Pressure Studies of Rotational Dynamics for Coumarin 153 in Alcohols and 
Alkanes
Naoki Ito, Okitsugu Kajimoto, and Kimihiko Hara
pp 6024 - 6029 
Vibrational Relaxation in -Carotene Probed by Picosecond Stokes and Anti-Stokes 
Resonance Raman Spectroscopy
David W. McCamant, Judy E. Kim, and Richard A. Mathies
pp 6030 - 6038
SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS
Ion-Complex Formation in Aqueous Solutions of Calcium Nitrate. Acoustical 
Absorption Spectrometry Study
R. Behrends, P. Miecznik, and U. Kaatze
pp 6039 - 6043 
Resolution of Benzophenone Delayed Fluorescence and Phosphorescence with 
Compensation for Thermal Broadening
Andrzej M. Turek, Govindarajan Krishnamoorthy, Kathleen Phipps, and Jack Saltiel
pp 6044 - 6052 
About the Atypical Behavior of CrO3, MoO3, and WO3 during Their UV Laser
Ablation/Ionization
Fr?d?ric Aubriet and Jean-Fran?ois Muller
pp 6053 - 6059 
KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY
Rate Constant for the Recombination Reaction CH3 + CH3  C2H6 at T = 298 and 202 K
Regina J. Cody, Walter A. Payne, Jr., R. Peyton Thorn, Jr., Fred L. Nesbitt, 
Mark A. Iannone, Dwight C. Tardy, and Louis J. Stief
pp 6060 - 6067 
Formation of HCl+(A2+) and HBr+(A2+) Resulting from He(23S) Penning Ionization 
of HCl and HBr
Ikuo Tokue, Hiroyuki Tanaka, Katsuyoshi Yamasaki, and Shinkoh Nanbu
pp 6068 - 6074 
Ternary H2SO4/HNO3/H2O Optical Constants: New Measurements from Aerosol 
Spectroscopy under Stratospheric Conditions
M. L. Norman, R. E. Miller, and D. R. Worsnop
pp 6075 - 6083 
Triplet Excited States and Radical Intermediates Formed in Electron Pulse 
Radiolysis of Amino and Dimethylamino Derivatives of Benzophenone
Ajay K. Singh, Dipak K. Palit, and Tulsi Mukherjee
pp 6084 - 6093 
A Shock Tube Study of Benzylamine Decomposition: Overall Rate Coefficient and 
Heat of Formation of the Benzyl Radical
Soonho Song, David M. Golden, Ronald K. Hanson, and Craig T. Bowman
pp 6094 - 6098 
MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL
THEORY
Two Uracil Molecules Connected by an Excess Electron
Caitlin S. Hall and Ludwik Adamowicz
pp 6099 – 6101
 
Polarizable Continuum Model (PCM) Calculations of Solvent Effects on Optical 
Rotations of Chiral Molecules
B. Mennucci, J. Tomasi, R. Cammi, J. R. Cheeseman, M. J. Frisch, F. J. Devlin, 
S. Gabriel, and P. J. Stephens
pp 6102 - 6113 
Structure and Bonding in [W10O32]n- Isopolyanions
Adam J. Bridgeman and Germ?n Cavigliasso
pp 6114 - 6120 
Silver Ion Binding Energies of Amino Acids: Use of Theory to Assess the Validity 
of Experimental Silver Ion Basicities Obtained from the Kinetic Method
Tamer Shoeib, K. W. Michael Siu, and Alan C. Hopkinson
pp 6121 - 6128 
Calculation of Resonances and Product State Distributions for the Unimolecular 
Dissociation of H2S
Hong Zhang and Sean C. Smith
pp 6129 - 6136; 
Lanczos Subspace Time-Independent Wave Packet Calculations of S (1D) + H2 
Reactive Scattering
Hong Zhang and Sean C. Smith
pp 6137 - 6142 
Chlorination Chemistry 4. Ab Initio Study of the Addition, Metathesis, and
Isomerization Channels Governing the Reaction of Chlorine Atom with Propargyl Chloride
Jeffrey W. Hudgens and Carlos Gonzalez
pp 6143 - 6153 
 (H2O)6 on a Virtual Metal Surface: Many-Body Effects in the Bilayer Structure
Timm Lankau
pp 6154 - 6160 
Ferromagnetic Coupling Behavior in Oxo-Bridged Binuclear Bis
(5-cyclopentadienyl)titanium(III) Complex (Cp2Ti)2(-O): A Density Functional 
Theory  Combined with Broken-Symmetry Approach
Qinghua Ren, Zhida Chen, Jie Ren, Haiyan Wei, Wentao Feng, and Lei Zhang
pp 6161 - 6166 
Prediction of the Dissociation Energy of Hexaphenylethane Using the 
ONIOM(MO:MO:MO)Method
Thom Vreven and Keiji Morokuma
pp 6167 - 6170 
Ab Initio and DFT Study of the Formation Mechanisms of Polycyclic Aromatic 
Hydrocarbons: The Phenanthrene Synthesis from Biphenyl and Naphthalene
V. V. Kislov, A. M. Mebel, and S. H. Lin
pp 6171 - 6182 
Equilibrium Structure and HCC Bending Potential Energy Function of 3A'' HCCN
Jacek Koput
pp 6183 - 6188 
The Transition State for Intramolecular Atom Exchange between Hydride and 
Dihydrogen Ligands
in cis-[Fe(PR3)4H(H2)]+ Complexes. Trishydride or Trihydrogen?
Heiko Jacobsen
pp 6189 - 6192 
A Direct Evaluation of the Partition Function and Thermodynamic Data for Water 
at High Temperatures
Frederico V. Prudente and Ant?nio J. C. Varandas
pp 6193 - 6200 
ONIOM Study of the Coordination Chemistry of Ag+ with the Nitrogen-Bridged 
Ligands Ph2P-NH-PPh2 and Ph2P-NCH3-PPh2: Ligand Chelation versus Bridging
Michael L. McKee and William E. Hill
pp 6201 - 6205 
GENERAL PHYSICAL CHEMISTRY
Photoejection of Electrons from Cycloocta[1,2,3,4-def;5,6,7,8-
d'e'f']bisbiphenylene Radical-Anion and Dianion Derivatives: Identification of a 
Light-Induced Disproportionation
Roy Shenhar, Itamar Willner, Andrzej Rajca, and Mordecai Rabinovitz
pp 6206 - 6212 
Thiacrown Ether Substituted Styryl Dyes: Synthesis, Complex Formation and 
Multiphotochromic Properties
Olga A. Fedorova, Yuri V. Fedorov, Artem I. Vedernikov, Sergey P. Gromov, Olga 
V. Yescheulova, Michael V. Alfimov, M. Woerner, Stefan Bossmann, Andre Braun, 
and Jack Saltiel
pp 6213 – 6222