Journal of Physical Chemistry A, 2003, V 107, N 16, 24 April.

ARTICLES

DYNAMICS AND RELAXATION
Site Specific Solvation Statics and Dynamics of Coumarin
Dyes in Hexane-Methanol Mixture
Tatiana Molotsky and Dan Huppert
pp 2769 - 2780;

Close-Coupling Time-Dependent Quantum Dynamics
Study of the H + HCl Reaction
Li Yao, Ke-Li Han, He-Shan Song, and Dong-Hui Zhang
pp 2781 - 2786; 

SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS

Local Ionization in 2-Phenylethyl-N,N-dimethylamine: Charge
Transfer and Dissociation Directly after Ionization
R. Weinkauf, L. Lehr, and A. Metsala
pp 2787 - 2799; 

Optical Rotatory and Circular Dichroic Scattering
Werner Kaminsky, Morten Andreas Geday,
Javier Herreros-Cedre's, and Bart Kahr
pp 2800 - 2807; 

Partially Bound Systems as Sensitive Probes of
Microsolvation: A Microwave and ab Initio Study of HCN···HCN-BF3
D. L. Fiacco and K. R. Leopold
pp 2808 - 2814; 

Photoinduced Electron Transfer from Nitoxide
Free Radicals to the Triplet State of C60
Yasuyuki Araki, Hongxia Luo, Shafiqul D.-M. Islam,
Osamu Ito, Michio M. Matsushita, and Tomokazu Iyoda
pp 2815 - 2820; 

Electronic and Structural Evolution of Monoiron Sulfur Clusters,
FeSn- and FeSn (n = 1-6), from Anion Photoelectron Spectroscopy
Hua-Jin Zhai, Boggavarapu Kiran, and Lai-Sheng Wang
pp 2821 - 2828; 

Collision-Induced Dissociation and Theoretical
Studies of Ag+(methanol)n, n = 1- 4
Hideya Koizumi, Melissa Larsen,
P. B. Armentrout, and David Feller
pp 2829 - 2838; 

Multiple Scattering Calculations of Bonding and X-ray
Absorption Spectroscopy of Manganese Oxides
B. Gilbert, B. H. Frazer, A. Belz, P. G. Conrad,
K. H. Nealson, D. Haskel, J. C. Lang, G. Srajer, and G. De Stasio
pp 2839 - 2847;

KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY

Enthalpies of Formation of Dibenzo-p-dioxin and
Polychlorinated Dibenzo-p-dioxins Calculated by
Density Functional Theory
Olga V. Dorofeeva and Vladimir S. Yungman
pp 2848 - 2854; 

Oxidative Degradation of Small Cationic Vanadium
Clusters by Molecular Oxygen: On the Way from
Vn+ (n = 2-5) to VOm+ (m = 1, 2)
Marianne Engeser, Thomas Weiske, Detlef Schro"der,
and Helmut Schwarz
pp 2855 - 2859; 

MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL THEORY

and Relaxation of Strain in Three-Membered Ring Molecules
(CH2)2X, (NH)2X, and (SiH2)2X (X = SiH2, PH, S)
Yuji Naruse, Jing Ma, and Satoshi Inagaki
pp 2860 - 2864; 

Reaction Mechanism of N2/H2 Conversion to NH3: A Theoretical Study
Der-Yan Hwang and Alexander M. Mebel
pp 2865 - 2874;  

Theoretical Study of Reactivities in Electrophilic Aromatic
Substitution Reactions: Reactive Hybrid Orbital Analysis
Hajime Hirao and Tomohiko Ohwada
pp 2875 - 2881; 

Aromaticity of Square Planar N42- in the M2N4
(M = Li, Na, K, Rb, or Cs) Species
Qian Shu Li and Li Ping Cheng
pp 2882 - 2889; 

Atoms in Molecules Computational Study on
the Molecular Structure of (Cu2S)n Clusters
Boris Ni, James R. Kramer, and Nick H. Werstiuk
pp 2890 - 2897; 

Combined Quantum Chemistry and Photoelectron
Spectroscopy Study of the Electronic Structure
and Reduction Potentials of Rubredoxin Redox Site Analogues
Shuqiang Niu, Xue-Bin Wang, Jeffrey A. Nichols,
Lai-Sheng Wang, and Toshiko Ichiye
pp 2898 - 2907; 

A Computational Study of Conformations and
Conformers of 1,3-Dithiane (1,3-Dithiacyclohexane)
Fillmore Freeman and Kelly Thuy Le
pp 2908 - 2918;

Thermal Fragmentation of 3-Vinyloxetane: A Quantum Chemical Study
S. Calvo-Losada, F. Enri'quez, J. Marti'n-Ortiz, and J. J. Quirante
pp 2919 - 2928;

Ab Intio and Kinetic Study on CH3 Radical Reaction with H2CO
Cheng-bin Che, Hui Zhang, Xiang Zhang, Yue Liu, and Bo Liu
pp 2929 - 2933;  

Density-Functional Calculations on Platinum
Nanoclusters: Pt13, Pt38, and Pt55
Edoardo Apra` and Alessandro Fortunelli
pp 2934 - 2942; 

Gas-Phase Reactivity of Lead(II) Ions with -Glucose.
Combined Electrospray Ionization Mass Spectrometry
and Theoretical Study
Jean-Yves Salpin and Jeanine Tortajada
pp 2943 - 2953;