Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.103, No.34 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (25 articles)

6685 - 6690	Pressure effect on hydrophobic hydration: Rotational dynamics of benzene Wakai C, Matubayasi N, Nakahara M
6691 - 6703	Distributions of site-hopping geometries and rates for benzene adsorbed on Ag-Y zeolite Gedeon A, Favre DE, Reichert D, MacNeil J, Chmelka BF
6704 - 6714	Intramolecular energy transfer in a covalently linked copper(II) porphyrin-free base porphyrin dimer: Novel spin polarization in the energy acceptor Asano-Someda M, van der Est A, Kruger U, Stehlik D, Kaizu Y, Levanon H
6715 - 6720	On the J-shift approximation in quantum reaction dynamics Nobusada K, Nakamura H
6721 - 6725	Matrix isolation and ab initio study of the reactions of magnesium atoms and clusters with CO2, C2H4, and CO2/C2H4 mixtures: Formation of cyclic complexes Solov'ev VN, Polikarpov EV, Nemukhin AV, Sergeev GB
6726 - 6739	Vibrational spectroscopy of the three isomers of 1,4-difluorobutadiene Craig NC, Neese CF, Nguyen TN, Oertel CM, Pedraza L, Chaka AM
6740 - 6745	Nanochemistry: Iron cluster reactions with methyl iodide McCarter BE, Bililign S, Feigerle CS, Miller JC
6746 - 6756	Two-dimensional penning ionization electron spectroscopy of NNO, HCNO, and HNNN: Electronic structure and the interaction potential with He*(2(3)S) metastable and Li(2(2)S) ground state atoms Pasinszki T, Kishimoto N, Ohno K
6757 - 6765	Effect of oxygen on the Belousov-Zhabotinsky reaction at low cerium concentrations Petrascu AM, Koch MHJ, Forsterling HD
6766 - 6771	Direct kinetics study of the reaction of peroxyacetyl radical with NO between 218 and 370 K Moise T, Denzer W, Rudich Y
6772 - 6777	Theoretical study on spectroscopic properties of positive, neutral, and negative species of BCl2 and AlCl2: The stability of the negative species Baeck KK, Choi H, Iwata S
6778 - 6785	How rapidly does the SH radical react with N2O? Herndon SC, Froyd KD, Lovejoy ER, Ravishankara AR
6786 - 6792	Structure of the sulfuric acid-ammonia system and the effect of water molecules in the gas phase Larson LJ, Largent A, Tao FM
6793 - 6799	Molecular electrostatic potential as reactivity index in hydrogen bonding: Ab initio molecular orbital study of complexes of nitrile and carbonyl compounds with hydrogen fluoride Galabov B, Bobadova-Parvanova P
6800 - 6804	A theoretical investigation of the torsional potential in 3,3'-dimethyl-2,2'-bithiophene and 3,4'-dimethyl-2,2'-bithiophene: A comparison between HF, MP2, and DFT theory Bongini A, Bottoni A
6805 - 6810	Electron tunneling: A scattering problem and a chemical approach. Interpretation of STM O-2 image Robert V
6811 - 6819	Hydrogen bonding in water clusters: Pair and many-body interactions from symmetry-adapted perturbation theory Milet A, Moszynski R, Wormer PES, van der Avoird A
6820 - 6824	Anionic 5-endo-trig cyclization of terminally difluorinated homoallylic alkoxides Yamazaki T, Hiraoka S, Sakamoto J, Kitazume T
6825 - 6834	Density functional study of tetra-atomic clusters and complexes of the group 16 elements: Trends in structure and bonding Orlova G, Goddard JD
6835 - 6844	Excitation energies for transition metal compounds from time-dependent density functional theory. Applications to MnO4-, Ni(CO)(4), and Mn-2(CO)(10) van Gisbergen SJA, Groeneveld JA, Rosa A, Snijders JG, Baerends EJ
6845 - 6850	Theoretical study of aluminum and gallium atom complexes with CO2, CS2, and COS Panek J, Latajka Z
6851 - 6861	Time-resolved resonance Raman and density functional study of the radical cation of promazine Pan D, Shoute LCT, Phillips DL
6862 - 6872	Ab initio study of the hydrolysis reactions of neutral and anionic Mg-pyrophosphate complexes in the gas phase Saint-Martin H, Vicent LE
6873 - 6879	Ionization dynamics of the benzene-HF complex: A direct ab initio dynamics study Tachikawa H
6880 - 6886	Application of relativistic quantum chemistry to the electronic energy levels of the uranyl ion Zhang ZY, Pitzer RM