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Attributs	Valeurs
type	work Issue
Is Part Of	http://hub.abes.fr/acs/periodical/jpcafh/2004/volume_108
has manifestation of work	http://hub.abes.fr/acs/periodical/jpcafh/2004/volume_108/issue_21/m/print http://hub.abes.fr/acs/periodical/jpcafh/2004/volume_108/issue_21/m/web
Date Copyrighted	2004
Rights	Copyright © 2004 American Chemical Society Copyright © 2004 by the American Chemical Society
issue	21
Rights Holder	American Chemical Society by the American Chemical Society
is Is Part Of of	Implementation of Neural Networks for the Identification of Single Molecules Mechanisms of Intramolecular Rearrangements of Cyclic Siloxycarbenes The Formic Acid−Trifluoroacetic Acid Bimolecule. Gas-Phase Infrared Spectrum andComputational Studies Structures of Nitrogen-Rich Sulfides: SN5 and SN6 Thermochemical Properties, Pathway, and Kinetic Analysis on the Reactions of Benzenewith OH: An Elementary Reaction Mechanism A Quantitative Structure−Property Relationship Study of Lithium Cation Basicities Ultrafast Excited and Ground-State Dynamics of the Green Fluorescent ProteinChromophore in Solution The Spin Dependence of the Spatial Size of Fe(II) and of the Structure of Fe(II)-Porphyrins Structures and Vibrational Frequencies of NaO3 and NaO3+: The Ionization Energy ofNaO3 Reaction of Benzene and Boron Atom: Mechanism of Formation of Benzoborirene andHydrogen Atom G2 Molecular Orbital Investigation of OCH+−XH, OCH+−X2, and OCH+−XY(YX)(X = Y = F, Cl, and Br) Proton Bond Complexes Carbon Dioxide Interactions with Crystalline and Amorphous Ice Surfaces Dissociation Potential Curves of Low-Lying States in Transition Metal Hydrides. 2.Hydrides of Groups 3 and 5 DFT Study of Nitroxide Radicals. 1. Effects of Solvent on Structural and ElectronicCharacteristics of 4-Amino-2,2,5,5-tetramethyl-3-imidazoline-N-oxyl Mechanistic Analysis of Optimal Dynamic Discrimination of Similar Quantum Systems On the Nature of Solvent Effects on Redox Properties Investigation of Magnetic Shielding in Xenon Difluoride Using Solid-State NMRSpectroscopy and Relativistic Density Functional Theory Matrix Isolated HgCH3 Radical: An ESR Investigation Probing the Photochemical Funnel of a Retinal Chromophore Model via Zero-Point EnergySampling Semiclassical Dynamics Beyond N8O6: Length Effects and End-Cap Effects on the Stability of a HexagonalNitrogen Tube Inelastic Neutron Scattering Study of the Activation of Molecular Hydrogen inSilver-Exchanged A Zeolite: First Step in the Reduction to Metallic Silver atLow Temperature Infrared Spectroscopy of Molten LiCl−KCl under Hydrogen Gas Atmosphere Molecular Structure and Pseudorotation of 1,1-Dichlorocyclopentane As Determined byGas-Phase Electron Diffraction and ab Initio Calculations: A Large Amplitude Treatment Spectroscopic Consequences of Localized Electronic Excitation in Anthranilic Acid Dimer Photophysical Studies of Porphyrins and Metalloporphyrins: Accurate Measurements ofFluorescence Spectra and Fluorescence Quantum Yields for Soret Band Excitation of ZincTetraphenylporphyrin Quantum Chemical Studies of the Structures and Vibrations of Trisilylmethane andTetrasilylmethane Electron-Diffraction Investigation of the Fluorofullerene C60F48 Solid-State 13C NMR Study of Chiral Twisted Conformation Attributable to Chirality inSmectic Phases of Achiral Banana-Shaped Molecules Doubly Hybrid Meta DFT: New Multi-Coefficient Correlation and Density FunctionalMethods for Thermochemistry and Thermochemical Kinetics Blue-Shifted and Red-Shifted Hydrogen Bonds in Hypervalent Rare-Gas FRg−H···YSandwiches

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