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Attributs	Valeurs
type	work Issue
Is Part Of	http://hub.abes.fr/acs/periodical/jpcafh/2003/volume_107
has manifestation of work	http://hub.abes.fr/acs/periodical/jpcafh/2003/volume_107/issue_22/m/print http://hub.abes.fr/acs/periodical/jpcafh/2003/volume_107/issue_22/m/web
Date Copyrighted	2003
Rights	Copyright © 2003 American Chemical Society
issue	22
Rights Holder	American Chemical Society
is Is Part Of of	A Detailed Mechanism of the Surface-Mediated Formation of PCDD/F from the Oxidationof 2-Chlorophenol on a CuO/Silica Surface Reduction of Substituted Benzenediazonium Salts by Hydrogen Atoms in Aqueous AcidicSolution Studied by Pulse Radiolysis Cavity Ring-Down Spectroscopy of the Benzyl Radical Activation of CH4 by Gas-Phase Zr+ and the Thermochemistry of Zr−Ligand Complexes Spatial Periodic Perturbation of Turing Pattern Development Using a Striped Mask Mechanism of Cis-to-Trans Isomerization of Azobenzene: Direct MD Study Laser-Induced Fluorescence Spectroscopy of the BaNC Free Radical in a Supersonic Jet Ester Hydrolysis Rate Constant Prediction from Quantum Topological Molecular SimilarityDescriptors Low-Temperature Fluorination of Silica by a Nonaqueous Solution of NH4F Structure and Stability of M−CO, M = First-Transition-Row Metal: An Application ofDensity Functional Theory and Topological Approaches Experimental and Computational Study of the Kinetics of OH + Pyridine and Its Methyl-and Ethyl-Substituted Derivatives Nanosecond Laser Photolysis of Ni(II) Tetraphenylporphyrin. Kinetic Studies on Associationand Dissociation of Aliphatic Amines at the Axial Positions Interpretation of Single-Crystal Vibrational Spectra and Entropy of Pyrope and AlmandineUsing a Rigid-Ion Lattice-Dynamical Model Mid-Infrared Spectrum of the Gas-Phase Ethyl Peroxy Radical: C2H5OO Is the Hydrogen Atomic Charge Representative of the Acidity of Parasubstituted Phenols? Variational Transition-State Theory Rate Constant Calculations of the OH + CH3SHReaction and Several Isotopic Variants Photodissociation of Methacrylonitrile at 193 nm: The CN Radical Product Channel Comparative Study of Molecular Mechanics and Theoretical Conformational Analysis of aNew 16-Crown-5 Ether via X-ray Crystallography and NMR Spectroscopy Modeling Complexes of the Uranyl Ion UO2L2n+: Binding Energies, Geometries, andBonding Analysis Structures, Intramolecular Rotation Barriers, and Thermochemical Properties of MethylEthyl, Methyl Isopropyl, and Methyl tert-Butyl Ethers and the Corresponding Radicals Oxygenation of α-Methylstyrene with Molecular Oxygen, Catalyzed by 10-MethylacridiniumIon via Photoinduced Electron Transfer Molecular Structure and Infrared Spectra of 4-Fluorophenol: A Combined Theoretical andSpectroscopic Study The Pitzer Free Rotor Model for Nondegenerate Modes: Application to the Long-RangeBehavior of Halogen Radical Reactions with Substituted Olefins Kinetic Study and Theoretical Analysis of Hydroxyl Radical Trapping and Spin AdductDecay of Alkoxycarbonyl and Dialkoxyphosphoryl Nitrones in Aqueous Media Measurements, Theory, and Modeling of OH Formation in Ethyl + O2 and Propyl + O2Reactions Binding Energies of the Neutral and Ionic Clusters of Naphthalene in Their GroundElectronic States Detailed Picosecond Kerr-Gated Time-Resolved Resonance Raman Spectroscopy andTime-Resolved Emission Studies of Merocyanine 540 in Various Solvents Raman Spectroscopy as a Probe of Low-Temperature Ionic Speciation in Nitric andSulfuric Acid Stratospheric Mimic Systems Mixed-Valence Properties of an Acetate-Bridged Dinuclear Ruthenium (II,III) Complex Reaction−Diffusion Patterns of the Chlorite−Tetrathionate System in a Conical Geometry Is Bimolecular Reduction of Hg(II) Complexes Possible in Aqueous Systems ofEnvironmental Importance Computational Analysis of Mo and W Oxoanions through Bond Order and Bonding EnergyApproaches

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