The Journal of Physical Chemistry A, 2000, V 104, N 34, 31 August.
FEATURE ARTICLE
7917-7926
Nonadiabatic Trajectories at an Exhibition
Michael D. Hack and Donald G. Truhlar
ARTICLES
DYNAMICS AND RELAXATION
7927-7933
Photolysis and Spectroscopy of Vibrationally Excited C-H Overtones of
CHFCl2
Aviva Melchior, Xiangling Chen, Ilana Bar, and Salman Rosenwaks
7934-7943
Solvation Statics and Dynamics in Electrolyte Solutions. The
Ion-Solvent Exchange Model
R. Argaman, T. Molotsky, and D. Huppert
SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS
7944-7949
Anharmonic Vibrational Spectroscopy Calculations for Novel
Rare-Gas-Containing Compounds: HXeH, HXeCl, HXeBr, and HXeOH
Jan Lundell, Galina M. Chaban and R. Benny Gerber
7950-7956
Association Forms of NO in Sodium Ion-Exchanged A-Type Zeolite:
Temperature-Dependent Q-Band EPR Spectra
Hidenori Yahiro, Anders Lund, Roland Aasa, Nikolas P. Benetis, and
Masaru Shiotani
7957-7963
Gas-Phase 1H NMR Studies of Internal Rotation Barriers and
Conformer Stabilities of N-Ethyl, N-Methylthioamides
Angela N. Taha, Susan M. Neugebauer-Crawford, and Nancy S. True
7964-7973
Manganese Carbonyl Nitrosyl Complexes in Solid Argon: Infrared Spectra
and Density Functional Calculations
Xuefeng Wang, Mingfei Zhou, and Lester Andrews
7974-7979
Vibrational Relaxation of OH and OD Stretching Vibrations of Phenol
and Its Clusters Studied by IR-UV Pump-Probe Spectroscopy
Takayuki Ebata, Atsushi Iwasaki, and Naohiko Mikami
KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY
7980-7994
Elucidation, by Scanning Microcalorimetry, of the Detailed Mechanism of the
Thermal Rearrangement of [18]Annulene into Benzene and 1,2-Benzo-1,3,7-
cyclooctatriene. Determination and Interpretation of the Thermochemical and
Kinetic Parameters of the Three Consecutive Reactions Implicated
Jean F. M. Oth, Jean-Marie Gilles
7995-8000
Kinetics and Mechanism of the Carbonate Ion Inhibited Aqueous Ozone
Decomposition
Attila Nemes, István Fábián, and Rudi van Eldik
8001-8010
Photodissociation of IO (355 nm) and OIO (532 nm): Quantum Yields for
O(3P) and I(2PJ) Production
Trevor Ingham, Melanie Cameron, and John N. Crowley
8011-8026
Reactions of Fe(CO)3 and Fe(CO)4 with
C2Cl4 in the Gas Phase Monitored by Transient Infrared
Spectroscopy: Formation of Fe(CO)4(C2Cl4),
Fe(CO)3(C2Cl4)2, and Novel Chloride
Complexes Resulting from the Oxidative Addition of C2Cl4
David L. Cedeño and Eric Weitz
8027-8032
Reaction Chemistry in the Afterglow of an Oxygen-Helium, Atmospheric-Pressure
Plasma
James Y. Jeong, Jaeyoung Park, Ivars Henins, Steve E. Babayan, Vincent J. Tu,
Gary S. Selwyn, Guowen Ding, and Robert F. Hicks
8033-8037
Controlling Chaos with Artificial Neural Network: Numerical Studies and
Experiments
István Z. Kiss and Vilmos Gáspár
8038-8044
FTIR Study of N2O3 on Porous Glass at Room Temperature
Michihiro Mochida and Barbara J. Finlayson-Pitts
8045-8049
Unexpected Phenomena in the Mercury(II)-Chlorite Ion System: Formation and
Kinetic Role of the HgClO2+ Complex
István Fábián and Dóra Szücs, Gilbert Gordon
MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL THEORY
8050-8057
Radiative and Nonradiative Excited State Relaxation Channels in Squaric Acid
Derivatives Bearing Differently Sized Donor Substituents: A Comparison of
Experiment and Theory
Claudia Gude and Wolfgang Rettig
8058-8066
Reaction Path Hamiltonian Analysis of Dynamical Solvent Effects for a Claisen
Rearrangement and a Diels-Alder Reaction
Hong Hu, Mark N. Kobrak, Changsen Xu, and Sharon Hammes-Schiffer
8067-8074
Complexation of Na+ and K+ to Aromatic Amino Acids:
A Density Functional Computational Study of Cation Interactions
Robert C. Dunbar
8075-8080
Thermochemistry of the Reactions F+(3P, 1D)
+ PH3 in the Gas Phase
Francisco Fernández-Morata, Manuel Alcamí, Leticia
González, and Manuel Yáñez
8081-8088
Artificial Neural Network Approach to Predict the Solubility of C60
in Various Solvents
István Z. Kiss, Géza Mándi, and Mihály T. Beck
8089-8096
Density Functional Study of the Interactions between Dihydrogen and
Pdn (n = 1-4) Clusters
Irena Efremenko, Ernst D. German, and Moshe Sheintuch
8097-8104
Structures of NO2+(H2O)n and
(HNO3)(H3O+)(H2O)n
-2 (n = 2-4) Clusters
R. C. Binning, Jr. and Yasuyuki Ishikawa
8105-8113
The Shielding Constants and Scalar Couplings in N-H···O=C and
N-H···N=C Hydrogen Bonded Systems: An ab Initio MO Study
Magdalena Pecul, Jerzy Leszczynski, and Joanna Sadlej
8114-8120
Ab Initio Molecular Orbital and Density Functional Studies on the Stable
Structures and Vibrational Properties of trans- and cis-Azobenzenes
Noriyuki Kurita, Shigenori Tanaka, and Satoshi Itoh
8121-8130
Unimolecular Decomposition of the 2-Oxepinoxy Radical: A Key Seven-Membered
Ring Intermediate in the Thermal Oxidation of Benzene
Michael J. Fadden and Christopher M. Hadad
GENERAL PHYSICAL CHEMISTRY
8131-8141
A Carbon-13 and Deuterium NMR Investigation of Solid Platinum-Ethylene
Complexes: Zeise's Salt and Pt(2-
C2H4)(PPh3)2
Guy M. Bernard, Roderick E. Wasylishen, and Andrew D. Phillips
8142-8145
Solid State Polymerization of Acetylene at High Pressure and Low Temperature
Chad C. Trout and J. V. Badding
8146-8153
Excited State Properties of Donor-Acceptor Substituted trans-Stilbenes:
The meta-Amino Effect
Frederick D. Lewis and Wilfried Weigel
ADDITIONS AND CORRECTIONS
8154-8154
Ab Initio Study of the Reactions between a Series of Substituted Singlet
Nitrenium Ions and Water
Manuel Marquez, Frank Mari, and Carlos A.Gonzalez