Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.105, No.32 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (32 articles)

7495 - 7500	Fluorescence anisotropy decay in polymer-surfactant aggregates Sen S, Sukul D, Dutta P, Bhattacharyya K
7501 - 7507	Phase and energy relaxation of vibrational motion and its manifestation in femtosecond pump-probe experiments on I-2 in rare gas environments Ermoshin VA, Engel V, Kazansky AK
7508 - 7513	Elementary reactions of energy-selected fluoroethene and 1,1-difluoroethene ions. 2. The kinetics of HF-loss Guthe F, Baumgartel H, Weitzel KM
7514 - 7524	Polarized infrared absorption spectra of matrix-isolated allyl radicals Nandi S, Arnold PA, Carpenter BK, Nimlos MR, Dayton DC, Ellison GB
7525 - 7533	Distinction between light and heavy lanthanide(III) ions based on the H-1 NMR spectra of heteroleptic triple-decker phthalocyaninato sandwich complexes Arnold DP, Jiang JZ
7534 - 7540	Photoelectron spectroscopy of yttrium oxide cluster anions: Effects of oxygen and metal atom addition Pramann A, Nakamura Y, Nakajima A, Kaya K
7541 - 7550	Infrared spectrum of the H3N-HI complex in solid Ne, Ar, Ne/Ar, Kr, and N-2. Comparisons of matrix effects on hydrogen-bonded complexes Andrews L, Wang XF
7551 - 7558	Theoretical investigation of the H3O+(H2O)(4) cluster Christie RA, Jordan KD
7559 - 7568	Laser-induced fluorescence of the CHClCHO radical and reaction of oxygen atoms with halogenated ethylenes Inomata S, Bridier I, Furubayashi M, Imamura T, Inoue G, Yamaguchi M, Washida N
7569 - 7578	UV spectrum of the high energy conformer of 1,3-butadiene in the gas phase Saltiel J, Sears DF, Turek AM
7579 - 7587	CH2+CO2 -> CH2O+CO, one-step oxygen atom abstraction or addition/fragmentation via alpha-lactone? Kovacs D, Jackson JE
7588 - 7597	Rate coefficients and mechanistic analysis for the reaction of hydroxyl radicals with 1,1-dichloroethylene and trans-1,2-dichloroethylene over an extended temperature range Yamada T, El-Sinawi A, Siraj M, Taylor PH, Peng JP, Hu XH, Marshall P
7598 - 7606	Atmospheric chemistry of three C-10 alkanes Aschmann SM, Arey J, Atkinson R
7607 - 7614	Reaction kinetics in ionic liquids: Pulse radiolysis studies of 1-butyl-3-methylimidazolium salts Behar D, Gonzalez C, Neta P
7615 - 7625	Theoretical analysis of heteroaromatic thioaminyl radicals. Part 1: A comparison of ab initio and density functional methods in calculations of molecular geometry and isotropic hyperfine coupling constants Kaszynski P
7626 - 7633	Theoretical analysis of heteroaromatic thioaminyl radicals. Part 2: A comparison of ab initio and density functional methods in the description of redox processes Kaszynski P
7634 - 7637	Ab initio investigation of hydrogenation of C-60 Okamoto Y
7638 - 7645	On the full topology of the Laplacian of the electron density II: Umbrella inversion of the ammonia molecule Malcolm NOJ, Popelier PLA
7646 - 7650	Classical and mixed quantum mechanical/molecular mechanical simulation of hydrated manganous ion Yague JI, Mohammed AM, Loeffler H, Rode BM
7651 - 7664	A Gaussian-2 ab initio study of the [C2H5S](-) potential energy surface: I. Structures and energetics of [C2H5S](-) anions and fragmentation pathways of the thioethoxide anion Chiu SW, Li WK
7665 - 7671	Stable hexacoordinated neutral complexes between silyl halides and two water or two ammonia molecules: SiX4Y2 (X = H, F, Cl; Y=H2O, NH3) Ignatyev IS, Schaefer HF
7672 - 7685	Accurate theoretical study of the excited states of boron and aluminum carbides, BC, AIC. 2 Tzeli D, Mavridis A
7686 - 7692	Ab initio study of the HF(X-1 Sigma(+)(g))-H(S-2) van der Waals complex Lukes V, Vrabel I, Laurinc V, Biskupic S
7693 - 7699	Stabilization of the pseudo-benzene N-6 ring with oxygen Wilson KJ, Perera SA, Bartlett RJ, Watts JD
7700 - 7706	Vibrational structure and vibronic coupling in the carbon 1s photoelectron spectra of ethane and deuteroethane Karlsen T, Saethre LJ, Borve KJ, Berrah N, Kukk E, Bozek JD, Carroll TX, Thomas TD
7707 - 7712	Direct ab initio dynamics calculations of the reaction rates for the hydrogen abstraction OH+HBr -> H2O+Br Liu JY, Li ZS, Dai ZW, Huang XR, Sun CC
7713 - 7723	Ab initio study of radical reactions: Cyclization pathways for the butylbenzene radical (II) Van Speybroeck V, Borremans Y, Van Neck D, Waroquier M, Wauters S, Saeys M, Marin GB
7724 - 7736	A systematic study of the reactions of OH- with chlorinated methanes. 1. Benchmark studies of the gas-phase reactions Borisov YA, Arcia EE, Mielke SL, Garrett BC, Dunning TH
7737 - 7744	Electronic structure, stability, and nature of bonding of the complexes of C2H2 and C2H4 with H+, Li+, and Na+ ions. Extensive ab initio and density functional study Kar T, Ponec R, Sannigrahi AB
7745 - 7750	C5H4: Pyramidane and its low-lying isomers Kenny JP, Krueger KM, Rienstra-Kiracofe JC, Schaefer HF
7751 - 7758	Multidimensional electron transfer pathways in a tetrahedral tetrakis{4-[N,N-di(4-methoxyphenyl)amino]phenyl}phosphonium salt: One-step vs two-step mechanism Lambert C, Noll G, Hampel F
7759 - 7764	Two-photon spectroscopy of pi-conjugated polymers: The case of poly[1,6-bis(3,6-dihexadecyl-N-carbazolyl)-2,4-hexadiyne] (polyDCHD-HS) Moroni L, Salvi PR, Gellini C, Dellepiane G, Comoretto D, Cuniberti C