Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.103, No.15 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (59 articles)

2477 - 2480	Large mass independent sulfur isotope fractionations during the photopolymerization of (CS2)-C-12 and (CS2)-C-13 Zmolek P, Xu XP, Jackson T, Thiemens MH, Trogler WC
2481 - 2488	Fluorescence of retinal Schiff base in alcohols Bachilo SM, Gillbro T
2489 - 2494	Reactivity index scale for interaction of heteroatomic molecules with zeolite framework Chatterjee A, Iwasaki T, Ebina T
2495 - 2500	Solvation dynamics in nonassociated polar solvents Biswas R, Bagchi B
2501 - 2505	Electron localization in polysilane radical ions Tachikawa H
2506 - 2512	Molecular dynamics simulations of the solvation of coumarin 153 in a mixture of an alkane and an alcohol Cichos F, Brown R, Rempel U, von Borczyskowski C
2513 - 2523	Fluorescence quenching kinetics of anthracene covalently bound to poly(methacrylic acid): Midchain labeling Clements JH, Webber SE
2524 - 2531	Control of the photophysical properties of polyatomic molecules by substitution and solvation: The second excited singlet state of azulene Tetreault N, Muthyala RS, Liu RSH, Steer RP
2532 - 2539	Multinuclear NMR investigation of Al(NO3)(3) and morpholine dissolved in water, in the presence and absence of HF Hansen EW, Vistad OB, Akporiaye DE, Lillerud KP, Wendelbo R
2540 - 2552	Multinuclear NMR analysis of SAPO-34 gels in the presence and absence of HF: The initial gel Vistad OB, Hansen EW, Akporiaye DE, Lillerud KP
2553 - 2560	Infrared spectrum of an acidic zeolite OH with adsorbed acetonitrile Meijer EL, van Santen RA, Jansen APJ
2561 - 2571	Cluster ion thermodynamic properties: The liquid drop model revisited Peslherbe GH, Ladanyi BM, Hynes JT
2572 - 2579	Multiphoton ionization and ab initio calculation studies of the hydrogen-bonded clusters C4H5N-(H2O)(n) Li Y, Liu XH, Wang XY, Lou NQ
2580 - 2591	Ultrafast dynamics of transition metal carbonyls. 3. Intracluster chemistry in [Cr(CO)(6)](n) Gutmann M, Dickebohm MS, Janello JM
2592 - 2598	Vibrational spectra and structures of nickel mononitrosyl complexes. An IR matrix isolation and DFT study Krim L, Manceron L, Alikhani ME
2599 - 2605	The mechanism of the solvent perturbation of the a(1)Delta(g)-> X-3 Sigma(-)(g) radiative transition of O-2 Schmidt R, Shafii F, Hild M
2606 - 2617	Vibronic behavior and single-crystal EPR spectra of Cu(II) in copper-doped diaqua(L-aspartato)zinc(II) hydrate Massa MB, Dalosto SD, Ferreyra MG, Labadie G, Calvo R
2618 - 2623	Photoinduced Rydberg ionization (PIRI) spectroscopy of the (B)over-tilde state of the fluorobenzene cation Anand R, LeClaire JE, Johnson PM
2624 - 2631	Infrared spectra of matrix-isolated [OC center dot center dot center dot X-2] and [CO center dot center dot center dot X-2] complexes (X = Cl, Br) and ab initio calculations Schriver A, Schriver-Mazzuoli L, Chaquin P, Bahou M
2632 - 2640	Atmospheric chemistry of trimethoxymethane, (CH3O)(3)CH; Laboratory studies Platz J, Sehested J, Nielsen OJ, Wallington TJ
2641 - 2648	Genuine pyrimidine radical cations generated by radiation-induced electron transfer to butyl chloride or acetone parent ions Lomoth R, Naumov S, Brede O
2649 - 2654	Rate constants for the reactions of hydroxyl radical with several alkanes, cycloalkanes, and dimethyl ether DeMore WB, Bayes KD
2655 - 2658	Consideration of the bimolecular reaction rates of D+(D2O)(n) with HCl MacTaylor RS, Gilligan JJ, Moody DJ, Castleman AW
2659 - 2663	Association reactions of manganese, iron, and ruthenium with nitric oxide McClean RE, Campbell ML, Vorce MD, Medhurst LJ
2664 - 2672	Measurement of the OH reaction rate constants for CF3CH2OH, CF3CF2CH2OH, and CF3CH(OH)CF3 Tokuhashi K, Nagai H, Takahashi A, Kaise M, Kondo S, Sekiya A, Takahashi M, Gotoh Y, Suga A
2673 - 2679	Phase transitions in emulsified HNO3/H2O and HNO3/H2SO4/H2O solutions Chang HYA, Koop T, Molina LT, Molina MJ
2680 - 2687	A kinetic and spectroscopic study of the in situ electrochemical promotion by sodium of the platinum-catalyzed combustion of propene Filkin NC, Tikhov MS, Palermo A, Lambert RM
2688 - 2695	Atmospheric chemistry of cyclohexane: UV spectra of c-C6H11 center dot and (c-C6H11)O-2(center dot) radicals, kinetics of the reactions of (c-C6H11)O-2(center dot) radicals with NO and NO2, and the fate of the alkoxy radical (c-C6H11)O-center dot Platz J, Sehested J, Nielsen OJ, Wallington TJ
2696 - 2699	Sonochemical degradation rates of volatile solutes Colussi AJ, Hung HM, Hoffmann MR
2700 - 2704	Kinetics of the reaction of OH radicals with CH2ClCF2Cl and CH2ClCF3 over an extended temperature range Fang TD, Taylor PH, Berry RJ
2705 - 2711	Charge transfer interactions in the generation of singlet oxygen O-2((1)Delta(g)) by strong electron donors Darmanyan AP, Lee W, Jenks WS
2712 - 2719	Kinetics of the reaction of OH with HI between 246 and 353 K Campuzano-Jost P, Crowley JN
2720 - 2722	Kinetics for the reactions of H3O+(H2O)(n) with CH3SOCH3 Thomas JM, Viggiano AA
2723 - 2733	Thermal decomposition and isomerization processes of alkyl radicals Yamauchi N, Miyoshi A, Kosaka K, Koshi M, Matsui N
2734 - 2739	Kinetics and mechanism of the sonolytic degradation of chlorinated hydrocarbons: Frequency effects Hung HM, Hoffmann MR
2740 - 2743	Experimental verification of the through-bond mechanisms of electron transfer in bridged donor-acceptor complexes Pullen SH, Edington MD, Studer-Martinez SL, Simon JD, Staab HA
2744 - 2750	A DFT study of the water-assisted intramolecular proton transfer in the tautomers of adenine Gu JD, Leszczynski J
2751 - 2755	Cation affinities of cyclohexadepsipeptide: Ab initio study Cui CZ, Kim KS
2756 - 2765	A density functional study of the acetoxylation of ethylene to vinyl acetate catalyzed by palladium acetate Kragten DD, van Santen RA, Neurock M, Lerou JJ
2766 - 2774	Ab initio calculations of carbonyl adsorption complexes at zeolitic Bronsted sites simulated by model clusters: Role of modeling Kassab E, Jessri H, Allavena M, White D
2775 - 2783	Contribution of hydrogen bonds to equilibrium alpha beta transition of resorcinol Yoshino M, Takahashi K, Okuda Y, Yoshizawa T, Fukushima N, Naoki M
2784 - 2792	Combined ab initio computational and statistical investigation of a model C-H center dot center dot center dot O hydrogen bonded dimer as occurring in 1,4-benzoquinone van de Bovenkamp J, Matxain JM, van Duijneveldt FB, Steiner T
2793 - 2800	Ab initio molecular orbital study of XO2+ (X = F, Cl, Br, I) systems Alcami M, Mo O, Yanez M, Cooper IL
2801 - 2811	A density functional theory study of the hydrates of NH3 center dot H2SO4 and its implications for the formation of new atmospheric particles Ianni JC, Bandy AR
2812 - 2820	A theoretical study of the pressure-induced dimerization of C-60 fullerene Dzyabchenko AV, Agafonov V, Davydov VA
2821 - 2827	Torsional potentials of perfluoro-1,3-butadiene and perfluoro-1,3,5-hexatriene: A comparison of ab initio and density functional results Karpfen A
2828 - 2835	Determination of the electronic structure of oligo(2-thienyl ketones) and extrapolation to poly(thienylene ketone) Dal Colle M, Cova C, Distefano G, Jones D, Modelli A, Comisso N
2836 - 2842	Dihydrogen bonding in main group elements: A case study of complexes of LiH, BH3, and AlH3 with third-row hydrides Kulkarni SA, Srivastava AK
2843 - 2850	Liquid structures and the infrared and isotropic/anisotropic Raman noncoincidence in liquid methanol, a methanol-LiCl solution, and a solvated electron in methanol: Molecular dynamics and ab initio molecular orbital studies Torii H
2851 - 2856	Comparison of the structures and vibrational modes of carboxybiotin and N-carboxy-2-imidazolidone Clarkson J, Carey PR
2857 - 2860	Quantum chemical calculations of the electronic states and fluorescence properties of carbazolyl- and carbazolymethylene-substituted diacetylenes Musso GF, Ottonelli M, Alloisio M, Moggio I, Comoretto D, Cuniberti C, Dellepiane G
2861 - 2866	On the magnetic susceptibility of fluorine Cheng H, Fowler DE, Henderson PB, Hobbs JP, Pascolini MR
2867 - 2872	Electronic structure and low-lying electronic states of Al3O and Al3O-: Photoelectron spectrum of Al3O- Ghanty TK, Davidson ER
2873 - 2877	Triplet ground state of 2,5-dimethylene five-member heterocycles Janicki SZ, Petillo PA
2878 - 2882	Theoretical studies of the electrocyclic reaction mechanisms of hexatriene to cyclohexadiene Sakai S, Takane S
2883 - 2890	Quantum molecular similarity. 1. BCP space Popelier PLA
2891 - 2898	Solvation and hydrogen-bonding effects on proton wires Decornez H, Drukker K, Hammes-Schiffer S
2899 - 2905	Thermal stability of O-H and O-alkyl bonds in N-alkoxyamines. A density functional theory approach Marsal P, Roche M, Tordo P, Claire PD
2906 - 2906	Real-time kinetic measurements of the condensation and evaporation of D2O molecules on ice at 140K < T < 220K (vol 102A, pg 10308, 1998) Chaix L, van den Bergh H, Rossi MJ