Journal of Physical Chemistry, 2004, V 108, N 14, April 8.

ARTICLES

DYNAMICS AND RELAXATION 
 
Rotamer Dynamics of Substituted Simple Alkanes. 
1. A Classical Trajectory Study of Collisional 
Orientation and Alignment of 1-Bromo-2-Chloroethane with Argon
H.-N. Lee, T.-M. Su, and I. Chao
pp 2567 - 2575;
 
 
Synthesis and Excited State Dynamics of -Oxo Group
IV Metal Phthalocyanine Oligomers: Trimers and Tetramers
Tissa Gunaratne, Vance O. Kennedy, Malcolm E. Kenney, 
and Michael A. J. Rodgers
pp 2576 - 2582; 
 
Photophysics and Ultrafast Relaxation Dynamics of the 
Excited States of Dimethylaminobenzophenone
Ajay K. Singh, G. Ramakrishna, Hirendra N. Ghosh, 
and Dipak. K. Palit
pp 2583 - 2597; 
 
Characterization of Solvent and Deuterium Isotope 
Effects on Nonadiabatic Proton Transfer in the
Benzophenone/N,N-Dimethylaniline Contact 
Radical Ion Pair
Kevin S. Peters and Ganghyeok Kim
pp 2598 - 2606; 

SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS 
 
Harmonic Model Description of the Franck-Condon 
Density for a Betaine Dye Molecule
Hyonseok Hwang and Peter J. Rossky
pp 2607 - 2616;  
 
CO2-Ethanol Interaction Studied by Vibrational 
Spectroscopy in Supercritical CO2
P. Lalanne, T. Tassaing, Y. Danten, F. Cansell, 
S. C. Tucker, and M. Besnard
pp 2617 - 2624; 
 
Full Valence Band Photoemission from Liquid
Water Using EUV Synchrotron Radiation
B. Winter, R. Weber, W. Widdra, M. Dittmar, 
M. Faubel, and I. V. Hertel
pp 2625 - 2632;
 
Magneto-Optical Investigations of Imidogen
in Inert-Gas Matrices
Jeremy J. Harrison, Bryce E. Williamson, 
and Janna L. Rose
pp 2633 - 2637; 
 
15N NMR Chemical Shift Tensors of Substituted
Hexaazaisowurtzitanes: The Intermediates 
in the Synthesis of CL-20
Jacalyn S. Clawson, Karen L. Anderson, 
Ronald J. Pugmire, and David M. Grant
pp 2638 - 2644; 
 
Molecular Structure of o-Benzyne from
Microwave Measurements
Stephen G. Kukolich, Michael C. McCarthy, 
and Patrick Thaddeus
pp 2645 - 2651; (
 
A Molecular Cluster Study on Activated CH/
Interactions: Infrared Spectroscopy of
Aromatic Molecule-Acetylene Clusters
Asuka Fujii, So-ichi Morita, Mitsuhiko Miyazaki, 
Takayuki Ebata, and Naohiko Mikami
pp 2652 - 2658; 

KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY 
 
Reactive Uptake of Nitric Acid into Aqueous
Sodium Chloride Droplets Using Real-Time 
Single-Particle Mass Spectrometry
Michael P. Tolocka, Thomas D. Saul, 
and Murray V. Johnston
pp 2659 - 2665; 
 
Kinetic Study for the Reactions of Several 
Hydrofluoroethers with Chlorine Atoms
Vassileios C. Papadimitriou, Kyriakos G. Kambanis, 
Yannis G. Lazarou, and Panos Papagiannakopoulos
pp 2666 - 2674; 
 
Oxidation of Safranine T in Aqueous Solution Using
Fenton's Reagent: Involvement of an Fe(III) 
Chelate in the Catalytic Hydrogen Peroxide 
Oxidation of Safranine T
P. K. Malik
pp 2675 - 2681; 
 
Association Complex Formation in Gas-Phase Ta 
Cluster Reactions with Simple Alkanes: Probing
the Role of Entropy in Rate Determination for 
Barrierless Adsorption Processes
David B. Pedersen, J. Mark Parnis, 
Rick D. Lafleur, and David M. Rayner
pp 2682 - 2689; 
 
High-Pressure Studies of Radical-Solvent
Molecule Interactions in the CCl3 and Bromine 
Combination Reactions of CCl3
Kawon Oum, Klaus Luther, and Jurgen Troe
pp 2690 - 2699;
 
Morphological Investigations of Single Levitated 
H2SO4/NH3/H2O Aerosol Particles during 
Deliquescence/Efflorescence Experiments
Christina A. Colberg, Ulrich K. Krieger, 
and Thomas Peter
pp 2700 - 2709; 

Quantum Yield for O(1D) Production from 
Ozone Photolysis in the Wavelength Range of 193-225 nm
Satoshi Nishida, Fumikazu Taketani, 
Kenshi Takahashi, and Yutaka Matsumi
pp 2710 - 2714; 
 
Development and Assessment of a New Hybrid 
Density Functional Model for Thermochemical Kinetics
Yan Zhao, Benjamin J. Lynch, and Donald G. Truhlar
pp 2715 - 2719; 

MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL THEORY 
 
Entropies in Solution from Entropies in the Gas Phase
Bonnie O. Leung, Darren L. Reid, 
David A. Armstrong, and Arvi Rauk
pp 2720 - 2725; 
 
DFT Analysis of Fe(H2O)63+ and Fe(H2O)62+ Structure 
and Vibrations; Implications for Isotope Fractionation
A. A. Jarzcki, A. D. Anbar, and T. G. Spiro
pp 2726 - 2732; 
 
Experimental Coordination Environment of 
Uranyl(VI) in Aqueous Solution
J. Neuefeind, L. Soderholm, and S. Skanthakumar
pp 2733 - 2739;
 
Structure-Reactivity Relationship in Ketones + OH Reactions: 
A Quantum Mechanical and TST Approach
J. Raul Alvarez-Idaboy, Armando Cruz-Torres, 
Annia Galano, and Ma. Esther Ruiz-Santoyo
pp 2740 - 2749;
 
Reaction Paths of Keto-Enol Tautomerization of -Diketones
Shinichi Yamabe, Noriko Tsuchida, and Kenta Miyajima
pp 2750 - 2757;  
 
Potential Energy and Spin-Spin Coupling 
Constants Surface of Glycolaldehyde
Tomasz Ratajczyk, Magdalena Pecul, 
Joanna Sadlej, and Trygve Helgaker
pp 2758 - 2769; 
 
Stochastic Approach to the Random Activation Energy 
Model with a Rate-Determining Step. Universal 
Behavior for the Probability of Concentration Fluctuations
Marcel O. Vlad, Stefan Muller, and John Ross
pp 2770 - 2779; 
 
Density Functional Theory Study of the Structures
and Properties of (H2AlN3)n (n = 1-4) Clusters
Qi Ying Xia, He Ming Xiao, Xue Hai Ju, and Xue Dong Gong
pp 2780 - 2786; 
 
Experimental and Theoretical Evaluation of
Proton Affinities of Furan, the Methylphenols, 
and the Related Anisoles
Eric S. E. van Beelen, Tehila A. Koblenz, 
Steen Ingemann, and Steen Hammerum
pp 2787 - 2793; 
 
Universal Features of the Topological Bond 
Properties of the Electron Density
Aurora Costales, M. A. Blanco, A. Martin Pendas, 
Paula Mori-Sanchez, and Victor Luana
pp 2794 - 2801; 

ADDITIONS AND CORRECTIONS 

 
Inclusion Complexes of 6-Bromo-2-Naphthol (Guest) 
and -Cyclodextrin (Host): Thermodynamics of the 
Binary Complex and First-Reported Dynamics 
of a Triplet-State Guest/Host2 Complex
R. Elizabeth Brewster, Benjamin F. Teresa, and Merlyn D. Schuh
pp 2802 - 2802;