Journal of Physical Chemistry A, 2003, V 107, N 11, 20 March.
FEATURE ARTICLE
Resonant Ionization Using IR Light: A New Tool To Study the Spectroscopy
and Dynamics of Gas-Phase Molecules and Clusters
Gert von Helden, Deniz van Heijnsbergen, and Gerard Meijer
pp 1671 - 1688;
ARTICLES
DYNAMICS AND RELAXATION
S1 Sn and S2 Sn Absorption of Azulene: Femtosecond Transient Spectra
and Excited State Calculations
Paolo Foggi, Frederik V. R. Neuwahl, Laura Moroni, and Pier Remigio Salvi
pp 1689 - 1696;
Luminescent Polymer Containing the Eu(III) Complex Having Fast Radiation
Rate and High Emission Quantum Efficiency
Yasuchika Hasegawa, Masaki Yamamuro, Yuji Wada,
Nobuko Kanehisa, Yasushi Kai, and Shozo Yanagida
pp 1697 - 1702;
SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS
On the Electronic Structure of [1Fe] Fe-S Complexes from Anionic
Photoelectron Spectroscopy
Xin Yang, Xue-Bin Wang, You-Jun Fu, and Lai-Sheng Wang
pp 1703 - 1709;
Combined Matrix-Isolation FT-IR and Theoretical Study of the Intrinsic Tautomeric,
Vibrational, and H-Bonding Properties of N4-Methoxycytosine
Riet Ramaekers, Wim Dehaen, Ludwik Adamowicz, and Guido Maes
pp 1710 - 1719;
Midinfrared and Quantum-Chemical Study of the Structure, Conformation,
and Isomerization of the Unstable CH3CH2OCN Molecule
Tibor Pasinszki, Bala'zs Havasi, and Attila Kova'cs
pp 1720 - 1726;
Exploration of the Laser-Assisted Clustering and Reactivity of
Trimethylaluminum with and without NH3
Alexander Demchuk, Steven Simpson, and Brent Koplitz
pp 1727 - 1733;
KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY
The Fenton Reaction. Dependence of the Rate on pH
Mordechai L. Kremer
pp 1734 - 1741;
Synergy in the Autoxidation of S(IV) Inhibited by Phenolic Compounds
Wanda Pasiuk-Bronikowska, Tadeusz Bronikowski, and Marek Ulejczyk
pp 1742 - 1748;
Gas-Phase Flow and Diffusion Analysis of the Droplet-Train/Flow-Reactor
Technique for the Mass-Accommodation Processes
Akihiro Morita, Masakazu Sugiyama, and Seiichiro Koda
pp 1749 - 1759;
Salt-Bridge Transition State for the Charge Separation Co(H2O)42+ CoOH(H2O)2+ + H3O+
Martin K. Beyer and Ricardo B. Metz
pp 1760 - 1762;
Oxidation of Nitrite by Peroxynitrous Acid
Patrick Maurer, Chris F. Thomas, Reinhard Kissner, Heinz Ru"egger,
Oswald Greter, Ursula Ro"thlisberger, and Willem H. Koppenol
pp 1763 - 1769;
Formation and Decay of an Aromatic Vinyl Cation in Supercritical CF3H
Toshihiko Arita and Okitsugu Kajimoto
pp 1770 - 1775;
Kinetics of the Reaction of C2Cl3 with Cl2
Sofya A. Kostina, Mikhail G. Bryukov, Alexander A. Shestov, and Vadim D. Knyazev
pp 1776 - 1778;
Identification of a Surface Alkylperoxy Radical in the Photocatalytic
Oxidation of Acetone/O2 over TiO2
Anna L. Attwood, John L. Edwards, Christopher C. Rowlands,
and Damien M. Murphy
pp 1779 - 1782;
Mercury Monoxide: A Systematic Investigation of Its Ground Electronic State
Benjamin C. Shepler and Kirk A. Peterson
pp 1783 - 1787;
MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL THEORY
Ab Initio/RRKM Study of the Potential Energy Surface of Triplet Ethylene
and Product Branching Ratios of the C(3P) + CH4 Reaction
Gap-Sue Kim, Thanh Lam Nguyen, Alexander M. Mebel,
Sheng H. Lin, and Minh Tho Nguyen
pp 1788 - 1796;
New Approach for Determining the Conformational Features of Pseudorotating
Ring Molecules Utilizing Calculated and Measured NMR Spin-Spin Coupling Constants
Anan Wu and Dieter Cremer
pp 1797 - 1810;
Raman, Infrared, and Surface-Enhanced Raman Spectroscopy in Combination
with ab Initio and Density Functional Theory Calculations on
10-Isopropyl-10H-phenothiazine-5-oxide
M. Bolboaca, T. Iliescu, Cs. Paizs, F. D. Irimie, and W. Kiefer
pp 1811 - 1818;
Gaussian-3 Molecular Orbital Study of the Reaction of Boron with Methylamine
and the Decomposition Paths of the Reaction Products
Suk Ping So
pp 1819 - 1824;
Analysis of the Pyramidalization of the Peptide Group Nitrogen:
Implications for Molecular Mechanics Energy Functions
Berit E. Mannfors, Noemi G. Mirkin, Kim Palmo, and Samuel Krimm
pp 1825 - 1832;
Rapid Estimation of Zero-Point Energies of Molecules Using Hartree-Fock
Atomic Partial Charges
Adrienn Ruzsinszky, Sa'ndor Kristya'n, Jo'zsef L. Margitfalvi, and Ga'bor I. Csonka
pp 1833 - 1839;
Molecular Geometry of Monomeric and Dimeric Yttrium Trichloride from
Gas-Phase Electron Diffraction and Quantum Chemical Calculations
Bala'zs Re'ffy, Colin J. Marsden, and Magdolna Hargittai
pp 1840 - 1849;
Theoretical Study of Two-Photon Absorption Properties of a Series
of Double-Layer Paracyclophane Derivatives
Xin Zhou, Ai-Min Ren, Ji-Kang Feng, and Xiao-Juan Liu
pp 1850 - 1858; (
Analyses of Nucleation Rates from Molecular Dynamics Simulations.
II. Weight Functions, Generation of Stochastic Times, and Realistic Uncertainties
E. Jean Jacob and Lawrence S. Bartell
pp 1859 - 1866;
Trimerization of Ethyne: Growth and Evolution of Ring Currents
in the Formation of the Benzene Ring
Remco W. A. Havenith, Patrick W. Fowler,
Leonardus W. Jenneskens, and Erich Steiner
pp 1867 - 1871;
Density Functional Theory Calculations of the Electron Paramagnetic
Resonance Parameters for VO2+ Complexes
Alexander C. Saladino and Sarah C. Larsen
pp 1872 - 1878;
Gas Phase Generation of HCCCS and CCCHS Radicals from Anionic
Precursors. The Rearrangement of CCCHS to HCCCS.
A Joint Experimental and Theoretical Study
Salvatore Peppe, Suresh Dua, Andrew M. McAnoy, and John H. Bowie
pp 1879 - 1886;
Electronic Structure of C5N2, C6N2, and Isoelectronic Molecules
K. Chuchev and J. J. BelBruno
pp 1887 - 1890;
GENERAL PHYSICAL CHEMISTRY
Thermodynamic Investigation on Self-Association of Alcohols in
Carbon Tetrachloride by FT-NMR Spectroscopy
Hemayat Shekaari, Hamid Modarress, and Naser Hadipour
pp 1891 - 1895;
COMMENTS
Comment on "Initiation and Abstraction Reactions in the Pyrolysis of Acetone"1
Charles N. Cawood, Hiroshi Furue, S. Hosein Mousavipour, and Philip D. Pacey
pp 1896 - 1896;