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Attributs	Valeurs
type	work Issue
Is Part Of	http://hub.abes.fr/acs/periodical/jpcafh/2006/volume_110
has manifestation of work	http://hub.abes.fr/acs/periodical/jpcafh/2006/volume_110/issue_18/m/print http://hub.abes.fr/acs/periodical/jpcafh/2006/volume_110/issue_18/m/web
Date Copyrighted	2006
Rights	Copyright © 2006 American Chemical Society
issue	18
Rights Holder	American Chemical Society
is Is Part Of of	Structures of Heterogeneous Proton-Bond Dimers with a High Dipole Moment Monomer: Covalent vs Electrostatic Interactions The Effect of Solvent Polarity on the Balance between Charge Transfer and Non-ChargeTransfer Pathways in the Sensitization of Singlet Oxygen by ππ* Triplet States Electronic Spectra of Hydrogen-Bonded 2-Fluoropyridine Clusters with Water in aSupersonic Free Jet Electron Transfer Reactivity in Matrix-Assisted Laser Desorption/Ionization (MALDI): Ionization Energy, Electron Affinity and Performance of the DCTB Matrix within theThermochemical Framework Structural and Conformational Properties and Intramolecular Hydrogen Bonding of(Methylenecyclopropyl)methanol, As Studied by Microwave Spectroscopy and QuantumChemical Calculations Empirical Description of Chiral Autocatalysis Self-Consistent Combination of the Three-Dimensional RISM Theory of MolecularSolvation with Analytical Gradients and the Amsterdam Density Functional Package The Electronic Spectrum of Chloroformic Acid in Comparison to Formic Acid Theoretical Study of Mixed Silicon−Lithium Clusters SinLip(+) (n = 1−6, p = 1−2) Coriolis-Coupled Wave Packet Dynamics of H + HLi Reaction On the Electronic Properties of Dehydrogenated Polycyclic Aromatic Hydrocarbons Density Functional Theory Study of the Properties of N−H···N, Noncooperativities, andIntermolecular Interactions in Linear trans-Diazene Clusters up to Ten Molecules Time-Dependent Wave Packet Studies on the Cl + HCl Hydrogen Exchange Reaction A Combined Electron Paramagnetic Resonance and Fourier Transform Infrared Study ofthe Co(C6H6)1,2 Complexes Isolated in Neat Benzene or in Cryogenic Matrixes New Experimental Data and Mechanistic Studies on the Bromate−Dual Substrate−DualCatalyst Batch Oscillator Resonance Raman Scattering of Rhodamine 6G as Calculated Using Time-DependentDensity Functional Theory Folded and Unfolded Conformations of the ω-3 Polyunsaturated Fatty Acid Family: CH3CH2[CHCHCH2]B[CH2]MCOOH. First Principles Study ZEKE-PFI Spectroscopy of Benzocaine Theoretical Study of Interaction of Urate with Li+, Na+, K+, Be2+, Mg2+, and Ca2+ MetalCations Solvent and pH Dependent Fluorescent Properties of a DimethylaminostyrylBorondipyrromethene Dye in Solution Theoretical Analysis of the Structural and Electronic Properties of Metalloporphyrinπ-Cation Radicals Mechanisms of Glycerol Dehydration Mechanistic Study of the CH3O2• + HO2• → CH3O2H + O2 Reaction in the Gas Phase.Computational Evidence for the Formation of a Hydrogen-Bonded Diradical Complex On the Competition between Scavenging and Recombination in Solutions ofMacromolecules Competing Isomerizations: A Combined Experimental/Theoretical Study ofPhenylpentenone Isomerism Raman Spectroscopic Study on Solvation of Diphenylcyclopropenone and Phenol Blue inRoom Temperature Ionic Liquids H-Atom Abstraction from CH3NHNH2 by NO2: CCSD(T)/6-311++G(3df,2p)//MPWB1K/6-31+G(d,p) and CCSD(T)/6-311+G(2df,p)//CCSD/6-31+G(d,p) Calculations Photoinduced Amino−Imino Tautomerism: An Infrared Study of2-Amino-5-methylpyridine in a Low-Temperature Argon Matrix Atom and Ion Chemistry in Low Pressure Hydrogen DC Plasmas

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