Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.105, No.49 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (28 articles)

10949 - 10951	Modeling of diffusion-reaction processes involving geminate radical pairs Kozak JJ, Nicolis C, Nicolis G, Turro NJ
10952 - 10960	Fluorescence and resonance Raman spectra of the aqueous solvated electron Tauber MJ, Mathies RA
10961 - 10966	Theory of cooling of room temperature benzene upon photo-excitation to the S-1 state He Y, Pollak E
10967 - 10977	Influence of solvent polarity and hydrogen bonding on the EPR parameters of a nitroxide spin label studied by 9-GHz and 95-GHz EPR spectroscopy and DFT calculations Owenius R, Engstrom M, Lindgren M, Huber M
10978 - 10985	Photoinduced electron transfer between C-60 and bis-diphenylamino (diphenylpolyenes), measurement of intrinsic quantum efficiency Han YN, Spangler LH
10986 - 10993	Reactive behavior of the [LiH2](+) system I. Evaluation of the lower-lying electronic potentials for the collinear geometries Bodo E, Gianturco FA, Martinazzo R, Raimondi M
10994 - 11000	Reactive behavior of the [LiH2](+) system II. Collision-induced dissociation and collinear reaction dynamics of LiH++H from quantum time dependent calculations Bodo E, Gianturco FA, Martinazzo R
11001 - 11008	A stark spectroscopic study of N(3)-methyl, N(10)-isobutyl-7,8-dimethylisoalloxazine in nonpolar low-temperature glasses: Experiment and comparison with calculations Stanley RJ, Siddiqui MS
11009 - 11017	The 4s <- 3p electronic transition in aluminum atom-molecule complexes: Bound and repulsive excited states Tan XF, Dagdigian PJ
11018 - 11025	Infrared spectra of silane in solid argon and hydrogen Li L, Graham JT, Weltner W
11026 - 11033	Photophysics of a bridged 7-diethylamino-4-methyl-coumarin C102: Studying the hydrogen bonding effect by time resolved stimulated emission Morlet-Savary F, Ley C, Jacques P, Fouassier JP
11034 - 11040	General expression for the effective mass in the one-dimensional treatment of tunneling corrections Gonzalez CA, Allison TC, Louis F
11041 - 11044	The dissociation energy of OH((XH3/2)-H-2) and the enthalpy of formation of OH(X-2 Pi(3/2)), ClOH, and BrOH from thermochemical cycles Joens JA
11045 - 11050	Cavity ring-down spectroscopic study of the reactions of Br atoms and BrO radicals with dimethyl sulfide Nakano Y, Goto M, Hashimoto S, Kawasaki M, Wallington TJ
11051 - 11056	Oxidation of triplet C-60 by hydrogen-bonded chloranil: Efficient formation, spectrum and charge-shift reactions of C-60+center dot cation radical Biczok L, Linschitz H
11057 - 11068	Collision-induced dissociation and theoretical studies of Na+-acetonitrile complexes Valina AB, Amunugama R, Huang H, Rodgers MT
11069 - 11072	Model potential calculations for various electronic excited states of Li- and Na- Magnier S, Aubert-Frecon M, Le Sech C
11073 - 11079	Bonding of rare-gas atoms to Si in reactions of rare gases with SiF3+ Cunje A, Baranov VI, Ling Y, Hopkinson AC, Bohme DK
11080 - 11087	Charge-separation process of the C2H4+Cl-2 reaction in water: A initio molecular orbital study using a cluster model Kurosaki Y
11088 - 11101	Theoretical reconstruction of the electron density of large molecules from fragments determined as proper open quantum systems: The properties of the oripavine PEO, enkephalins, and morphine Matta CF
11102 - 11109	Solvent effect on electronegativity, hardness, condensed Fukui functions, and softness, in a large series of diatomic and small polyatomic molecules: Use of the EFP model Safi B, Balawender R, Geerlings P
11110 - 11117	Thermosolvatochromism of betaine-30 in CH3CN Zhao XH, Burt JA, Knorr FJ, McHale JL
11118 - 11127	Excited-state structure and delocalization in ruthenium(II)-bipyridine complexes that contain phenyleneethynylene substituents Wang YS, Liu SX, Pinto MR, Dattelbaum DM, Schoonover JR, Schanze KS
11128 - 11133	Isomerization and dissociation of ionized dimethyl sulfoxide: A theoretical insight Bouchoux G, Le HT, Nguyen MT
11134 - 11143	Flat potential energy surface of the saturated binuclear homoleptic chromium carbonyl Cr-2(CO)(11) with one, two, and three bridging carbonyls: Comparison with the well-known [HCr2(CO)(10)](-) anion and the related [(mu-H)(2)Cr-2(CO)(9)](2-) and [(mu-H)(2)Cr-2(CO)(8)](2-) dianions Richardson NA, Xie YM, King RB, Schaefer HF
11144 - 11155	Hydrogen atom adducts to the amide bond. Generation and energetics of the amino(hydroxy)methyl radical in the gas phase Syrstad EA, Turecek F
11156 - 11157	Comment on "Using Kohn-Sham orbitals in symmetry-adapted perturbation theory to investigate intermolecular interactions" Jansen G, Hesselmann A
11158 - 11158	Reply to comment on "Using Kohn-Sham orbitals in symmetry-adapted perturbation theory to investigate intermolecular interactions" Williams HL, Chabalowski CF