Journal of Physical Chemistry A, V 108, N 37, September 16.

LETTERS 

NMR Spectroscopic Evidence for an Intermediate
of Formic Acid in the Water-Gas-Shift Reaction
Ken Yoshida, Chihiro Wakai, Nobuyuki Matubayasi, 
and Masaru Nakahara
pp 7479 - 7482; 

ARTICLES

DYNAMICS AND RELAXATION 
 
Fast Photodynamics of Aqueous Formic Acid
Jan Thgersen, Svend Knak Jensen, 
Ove Christiansen, and Sren R. Keiding
pp 7483 - 7489; 
 
Cavity Size Effect on the Excited StateDynamics
of Methyl 4-(Dimethylamino)benzoate-Cyclodextrin
Complexes
Yoshihisa Matsushita, Tadashi Suzuki, 
Teijiro Ichimura, and Takumi Hikida
pp 7490 - 7496; 
 
Photoinduced Electron Transfer in Self-Assembled
Dimers of 3-Fold Symmetric Donor-Acceptor
Molecules Based on Perylene-3,4:9,10-bis(dicarboximide)
Boris Rybtchinski, Louise E. Sinks, 
and Michael R. Wasielewski
pp 7497 - 7505; 

SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS 
 
Base-Catalyzed Hydrogen/Deuterium Exchange
between Water and Acetonitrile in Anionic
Water Clusters
O. Petru Balaj, Chi-Kit Siu, Iulia Balteanu,
Brigitte S. Fox-Beyer, Martin K. Beyer, 
and Vladimir E. Bondybey
pp 7506 - 7512; 
 
Vibrational Spectroscopic and Density
Functional Studies on Ion Solvation 
and Association of Lithium Tetrafluorobrate
in Acetonitrile
Xiaopeng Xuan, Hucheng Zhang, 
Jianji Wang, and Hanqing Wang
pp 7513 - 7521; 

Aggregation-Induced Emission of
cis,cis-1,2,3,4-Tetraphenylbutadiene 
from Restricted Intramolecular Rotation
Junwu Chen, Bin Xu, Xiaoying Ouyang,
Ben Zhong Tang, and Yong Cao
pp 7522 - 7526; 

KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY 
 
Low-Temperature Reactions of OH Radicals
with Propene and Isoprene in Pulsed 
Laval Nozzle Expansions
Tim Spangenberg, Sven Kohler,
Bjorn Hansmann, Uwe Wachsmuth, 
Bernd Abel, and Mark A. Smith
pp 7527 - 7534; 

A Kinetic Analysis of the Effect of O2 
on the Reactions of Atomic Bromine
with Some Hydrocarbons and Ethers
Lori M. Anthony and John M. Roscoe
pp 7535 - 7547; 

Ionic Reactions between Formaldehyde
and Hydrocarbons. H2 Transfer as a
Hydrogenation Mechanism in Astrochemistry
Gregory J. Francis, Paul F. Wilson, 
Robert G. A. R. Maclagan, Colin G. Freeman, 
Michael Meot-Ner (Mautner),
and Murray J. McEwan
pp 7548 - 7553;
 
Mechanistic Investigations on the 
Belousov-Zhabotinsky Reaction with 
Oxalic Acid Substrate. 2. Measuring and
Modeling the Oxalic Acid-Bromine 
Chain Reaction and Simulating the 
Complete Oscillatory System
Krisztina Pelle, Maria Wittmann, 
Klara Lovrics, and Zoltan Noszticzius
pp 7554 - 7562;  

MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL THEORY 
 
Atom-Bond Electronegativity Equalization
Method Fused into Molecular Mechanics.
II. A Seven-Site Fluctuating Charge and 
Flexible Body Water Potential Function
for Liquid Water
Yang Wu and Zhong-Zhi Yang
pp 7563 - 7576; 
 
Absorption and Fluorescence of 
3-Methylindole: A Theoretical Study,
Including H2O Interactions
Ken R. F. Somers and Arnout Ceulemans
pp 7577 - 7583;

Radiationless Decay of Excited States
of Uracil through Conical Intersections
Spiridoula Matsika
pp 7584 - 7590; 
 
Dependence of -Proton Hyperfine
Couplings on Free Radical Geometry
Paul A. Erling and William H. Nelson
pp 7591 - 7595; 
 
Density Functional Theory Studies
on Structure, Spectra, and Electroni
c Properties of 3,7-Dinitrodibenzobromolium
Cation and Chloride
Xin Huai Zhang, Yuan Ping Feng,
and Yu Zong Chen
pp 7596 - 7602; 
 
Tautomerism in Hydroxynaphthaldehyde
Anils and Azo Analogues: a Combined
Experimental and Computational Study
Walter M. F. Fabian, Liudmil Antonov, 
Daniela Nedeltcheva, Fadhil S. Kamounah, 
and Peter J. Taylor
pp 7603 - 7612; 
 
Computational Study of the Reactions
between XO (X = Cl, Br, I) and Dimethyl Sulfide
Hasan Sayin and Michael L. McKee
pp 7613 - 7620;
 
Performance of Density Functionals for 
Calculating Barrier Heights of Chemical
Reactions Relevant to Astrophysics
Stefan Andersson and Myrta Gruning
pp 7621 - 7636;