Journal of Physical Chemistry, 2003, V 107, N 24, 19 June

LETTERS


Hidden Breakdown of Linear Response: Projections of Molecular
Motions in Nonequilibrium Simulations of Solvation Dynamics
Michael J. Bedard-Hearn, Ross E. Larsen, and Benjamin J. Schwartz
pp 4773 - 4777;

ARTICLES

DYNAMICS AND RELAXATION

Three-Color Three-Laser Photochemistry of
Di(p-methoxyphenyl)methyl Chloride
Michihiro Hara, Sachiko Tojo, and Tetsuro Majima
pp 4778 - 4783; 

Solution Dynamics in Aqueous Monohydric Alcohol Systems
William S. Price, Hiroyuki Ide, and Yoji Arata
pp 4784 - 4789;

Size-Dependent Diffusion in the n-Alkanes
Bruce A. Kowert, Kurtis T. Sobush, Chantel F. Fuqua, 
Courtney L. Mapes, Jared B. Jones, and Jacob A. Zahm
pp 4790 - 4795; 

Kinetic Study on Vibrational Relaxation of 
SO(B3  -,
v' = 1 and 2) by Collisions with He
Katsuyoshi Yamasaki, Fumikazu Taketani,
Yuichi Takasago, Kazuyuki Sugiura, and Ikuo Tokue
pp 4796 - 4800;

Photoinduced Electron Transfer in "Two-Point" Bound
Supramolecular Triads Composed of N,N-Dimethylaminophenyl
-Fullerene-Pyridine Coordinated to Zinc Porphyrin
Francis D'Souza, Gollapalli R. Deviprasad, Melvin E. Zandler,
Mohamed E. El-Khouly, Mamoru Fujitsuka, and Osamu Ito
pp 4801 - 4807; 

SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS

Photophysical Properties of Coumarin-152 and Coumarin-481 Dyes:
Unusual Behavior in Nonpolar and in Higher Polarity Solvents
Sanjukta Nad, Manoj Kumbhakar, and Haridas Pal
pp 4808 - 4816; 

Gas-Phase Solvation of O2+, O2-, O4-, O3-, and CO3- with CO
Kenzo Hiraoka, Jun Katsuragawa, Teruaki Sugiyama,
Susumu Fujimaki, Takanori Kojima, and Shinichi Yamabe
pp 4817 - 4825;

First Excited and Cationic Ground States of Jet-Cooled 2-Aminopyridine
 Arn (n = 1, 2)
Clusters: Energetics and Structures
Sun Jong Baek, Kyo-Won Choi, 
Young S. Choi, and Sang Kyu Kim
pp 4826 - 4828; 

Step-Scan Fourier-Transform Infrared Absorption
Spectroscopy of Cubic Solid Acetylene Clusters
Shinichi Hirabayashi, Noriaki Yazawa, and Yasuhiro Hirahara
pp 4829 - 4833; 

KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY

Role of the Reactor Geometry in the Onset of Transient
Chaos in an Unstirred Belousov-Zhabotinsky System
Maria Liria Turco Liveri, Renato Lombardo,
Marco Masia, Giuseppe Calvaruso, and Mauro Rustici
pp 4834 - 4837; 

Kinetic Study for the Reactions of Si Atoms with SiH4
Makoto Koi, Kenichi Tonokura, Atsumu Tezaki, and Mitsuo Koshi
pp 4838 - 4842; 

Infrared Laser Absorption Measurements of the Kinetics
of Propargyl Radical Self-Reaction and the 193 nm
Photolysis of Propyne
John D. DeSain and Craig A. Taatjes
pp 4843 - 4850; 

Thermal Decomposition and Ring Expansion in 2,4-Dimethylpyrrole.
Single Pulse Shock Tube and Modeling Studies
Assa Lifshitz, Aya Suslensky, and Carmen Tamburu
pp 4851 - 4861;

MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL THEORY

Topological Analysis of the Reaction of Mn+ (7S,5S) 
with H2O, NH3, and CH4 Molecules
Maria del Carmen Michelini, Emilia Sicilia, Nino Russo,
Mohamnad Esmail Alikhani, and Bernard Silvi
pp 4862 - 4868; 

Application of the Hilbert-Huang Transform to the
Analysis of Molecular Dynamics Simulations
Stephen C. Phillips, Robert J. Gledhill,
Jonathan W. Essex, and Colin M. Edge
pp 4869 - 4876; 

Effect of Spherical Confinement on Chemical Reactivity
P. K. Chattaraj and U. Sarkar
pp 4877 - 4882;

Phosphaalkenes with Inverse Electron Density: Electrochemistry,
Electron Paramagnetic Resonance Spectra, and Density
Functional Theory Calculations of Aminophosphaalkene Derivatives
Patrick Rosa, Cyril Gouverd, Ge'rald Bernardinelli, 
The'o Berclaz, and Michel Geoffroy
pp 4883 - 4892; 

Theoretical Estimations of the 298 K Gas-Phase Acidities 
of the Pyrimidine-Based Nucleobases Uracil, Thymine, and Cytosine
Yiqun Huang and Hilkka Kentta"maa
pp 4893 - 4897; 

Modeling the Oxidative Degradation of Azo Dyes:
A Density Functional Theory Study
Alimet S. O"zen, Viktorya Aviyente, and Roger A. Klein
pp 4898 - 4907; 

Thermodynamic Properties and Kinetic Parameters
for Cyclic Ether Formation from Hydroperoxyalkyl Radicals
Catherina D. Wijaya, Raman Sumathi, and William H. Green, Jr.
pp 4908 - 4920; 

Theoretical Study and Rate Constant Calculation
of the Cl + HOCl and H + HOCl Reactions
Li Wang, Jing-yao Liu, Ze-sheng Li, Xu-ri Huang, and Chia-chung Sun
pp 4921 - 4928; 

Activation and Adsorption of Multiple H2 Molecules
on a Pd5 Cluster: A Density Functional Study
Jerzy Moc, Djamaladdin G. Musaev, and Keiji Morokuma
pp 4929 - 4939; 

Time-Dependent Density Functional Study of the
Electronic Excited States of Polycyclic Aromatic Hydrocarbon Radical Ions
So Hirata, Martin Head-Gordon, Jan Szczepanski, and Martin Vala
pp 4940 - 4951; 

Anharmonic Vibrational Spectroscopy of the F-(H2O)n Complexes, n = 1, 2
Galina M. Chaban, Sotiris S. Xantheas, and R. Benny Gerber
pp 4952 - 4956; 

Structure, Deprotonation Energy, and Cation Affinity
of an Ethynyl-Expanded Cubane
Steven M. Bachrach
pp 4957 - 4961; 

Evaluation of Magnetic Properties as a Criterion for the
Elucidation of the Pseudopericyclic Character of
1,5-Electrocyclizations in Nitrile Ylides
Enrique M. Cabaleiro-Lago, Jesu's Rodri'guez-Otero, and Jose M. Hermida-Ramo'n
pp 4962 - 4966; 

Relativistic Density-Functional Computations
of the Chemical Shift of 129Xe in Xe@C60
Jochen Autschbach and Eva Zurek
pp 4967 - 4972;