Journal of Physical Chemistry A, 2003, V 107, N 10, 13 March.
ARTICLES
DYNAMICS AND RELAXATION
Time-Resolved Electron Paramagnetic Resonance Study of the First Excited Triplet
States of Dibenzocycloheptadienylidene and Diphenylmethylene Derivatives
Kimio Akiyama, Atsuko Suzuki, Hiromi Morikuni, and Shozo Tero-Kubota
pp 1447 - 1451;
Solvent Polarity Dependence of Photoinduced Charge Separation and
Recombination Processes of Ferrocene-C60 Dyads
Mamoru Fujitsuka, Norie Tsuboya, Ryo Hamasaki, Masateru Ito,
Shinji Onodera, Osamu Ito, and Yoshinori Yamamoto
pp 1452 - 1458;
Comprehensive Studies on Dual Excitation Behavior of Double Proton
versus Charge Transfer in 4-(N-Substituted amino)-1H-pyrrolo[2,3-b]pyridines
Chung-Chih Cheng, Chen-Pin Chang, Wei-Shan Yu,
Fa-Tsai Hung, Yun-I Liu, Guo-Ray Wu, and Pi-Tai Chou
pp 1459 - 1471;
Ultraviolet Photodissociation Dynamics of Cl2 and CFCl3
Adsorbed on Water Ice Surfaces
Akihiro Yabushita, Masahiro Kawasaki, and Shinri Sato
pp 1472 - 1477;
The Lowest Photoexcited Triplet State of Subphthalocyanine in
Solid and Fluid Environments. Time-Resolved Electron
Paramagnetic Resonance Studies
Seigo Yamauchi, Akihiro Takahashi, Yohei Iwasaki, Masashi Unno,
Yasunori Ohba, Jiro Higuchi, Aharon Blank, and Haim Levanon
pp 1478 - 1485;
SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS
Infrared Spectroscopy of Matrix-Isolated Polycyclic Aromatic Compounds and
Their Ions. 6. Polycyclic Aromatic Nitrogen Heterocycles
A. L. Mattioda, D. M. Hudgins, C. W. Bauschlicher, Jr, M. Rosi, and L. J. Allamandola
pp 1486 - 1498;
KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY
Kinetic Studies on the Reactions of Hydroxyl Radicals with Cyclic Ethers and Aliphatic Diethers
Jennie Moriarty, Howard Sidebottom, John Wenger, Abdelwahid Mellouki, and Georges Le Bras
pp 1499 - 1505;
Solvated Electron Pairing with Earth Alkaline Metals in THF. 1. Formation and Structure
of the Pair with Divalent Magnesium
F. Renou, M. Mostafavi, P. Archirel, L. Bonazzola, and P. Pernot
pp 1506 - 1516;
Kinetics and Mechanism of the Addition of Aliphatic Amines to Transient Silenes
William J. Leigh and Xiaojing Li
pp 1517 - 1524;
Kinetics and Mechanism for the Metalation of 5,10,15,20-Tetrakis(pentafluorophenyl)porphyrin
with Bis(-diketonato)copper(II) Complexes in Supercritical Carbon Dioxide and n-Hexane
Yasuhiro Inada, Hideyuki Sato, Shi-jun Liu, Taichi Horita, and Shigenobu Funahashi
pp 1525 - 1531;
Dissociation, Relaxation, and Incubation in the Pyrolysis of Neopentane:
Heat of Formation for tert-Butyl Radical
N. K. Srinivasan, J. H. Kiefer, and R. S. Tranter
pp 1532 - 1539;
MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL THEORY
Microsolvation of Alkali and Halide Ions in Acetonitrile Clusters
Tao-Nha^n V. Nguyen and Gilles H. Peslherbe
pp 1540 - 1550;
Density Functional Theory Investigation of the Reaction of the Chlorine
Atom-Carbon Disulfide Molecular Complex with Dimethylbutane:
Implications for Tertiary Selectivity in Alkane Photochlorination Reactions
Dongqi Wang, David Lee Phillips, and Wei-Hai Fang
pp 1551 - 1556;
Photochemistry of HCl(H2O)4: Cluster Model of the Photodetachment
of the Chloride Anion in Water
Andrzej L. Sobolewski and Wolfgang Domcke
pp 1557 - 1562;
Differences and Similarities in the Reactivity of Peroxynitrite Anion
and Peroxynitrous Acid with Ebselen. A Theoretical Study
Djamaladdin G. Musaev and Kimihiko Hirao
pp 1563 - 1573;
Structures and Hydrogen Bonding Analysis of N,N-Dimethylformamide
and N,N-Dimethylformamide-Water Mixtures by
Molecular Dynamics Simulations
Yi Lei, Haoran Li, Haihua Pan, and Shijun Han
pp 1574 - 1583;
Theoretical Studies for the Structural Properties and Electron Transfer
Reactivity of C4H5N/C4H5N+ Coupling System
Qiao Sun, Yuxiang Bu, and Mei Qin
pp 1584 - 1596;
Electronic Structure Properties of Carbazole-like Compounds
: Implications for Asphaltene Formation
I. Garci'a-Cruz, J. M. Marti'nez-Magada'n, P. Guadarrama, R. Salcedo, and F. Illas
pp 1597 - 1603;
Coupled Cluster Theory Determination of the Heats of Formation of
Combustion-Related Compounds:
CO, HCO, CO2, HCO2, HOCO, HC(O)OH, and HC(O)OOH
David Feller, David A. Dixon, and Joseph S. Francisco
pp 1604 - 1617;
Ab Initio and Variational Transition-State Theory Study of the CF3CF2OCH3 + OH
Reaction Using Integrated Methods: Mechanism and Kinetics
J. Espinosa-Garci'a
pp 1618 - 1626;
Electron Delocalization in Isocyanates, Formamides, and Ureas
Importance of Orbital Interactions
Prasad V. Bharatam, Rajnish Moudgil, and Damanjit Kaur
pp 1627 - 1634;
Gas Phase Reactions between SiH4 and B2H6: A Theoretical Study
Shao-Wen Hu, Yi Wang, and Xiang-Yun Wang
pp 1635 - 1640;
Quantum Chemical Study on the Decomposition of N2O with O-, O2-, and O3-
Elly J. Karlsen and Lars G. M. Pettersson
pp 1641 - 1646;
Stabilization of an All-Nitrogen Molecule by Oxygen Insertion: Dissociation
Pathways of N8O6
Douglas L. Strout
pp 1647 - 1650;
Ab Initio MP2 and DFT Study of the Thermal Syn Elimination Reaction in Ethyl Formate
Jose M. Hermida-Ramo'n, Jesu's Rodri'guez-Otero, and Enrique M. Cabaleiro-Lago
pp 1651 - 1654;
Using Constrained Schro"dinger Equations to Separate Resonant and Inductive
Substituent Effects: A New Methodology for Parametrizing Simple Models in Chemistry
Benjamin G. Janesko, Craig J. Gallek, and David Yaron
pp 1655 - 1663;
GENERAL PHYSICAL CHEMISTRY
On Chemical Reactors That Can Count
J. Gorecki, K. Yoshikawa, and Y. Igarashi
pp 1664 - 1669;
ADDITIONS AND CORRECTIONS
Magnesium Clusters: Structural and Electronic Properties and the
Size-Induced Nonmetal-to-Metal Transition
Julius Jellinek and Paulo H. Acioli:
pp 1670 - 1670;
Mesoscopic Treatment of a Fluid/Liquid Interface. 1. Theory
Aly J. Castellanos, German Urbina-Villalba, and Ma'ximo Garci'a-Sucre:
pp 1670 - 1670;
Mesoscopic Treatment of a Fluid/Liquid Interface. 2. Air/Water Interfacial Tension
Aly J. Castellanos, German Urbina-Villalba, and Ma'ximo Garci'a-Sucre:
pp 1670 - 1670;