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;