Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.104, No.12 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (41 articles)

2527 - 2530	Dynamics of the charge-transfer-to-solvent states in I-(Xe)n clusters Zanni MT, Frischkorn C, Davis AV, Neumark DM
2531 - 2541	Aspects of photoinduced molecular three-body decay Maul C, Gericke KH
2542 - 2551	Twisted intramolecular charge transfer of 2-(4 ＇-N,N-dimethylaminophenyl)pyrido[3,4-d]imidazole in cyclodextrins: Effect of pH Krishnamoorthy G, Dogra SK
2552 - 2561	Femtosecond dynamics of the methane-methanol and benzene-phenol conversions by an iron-oxo species Yoshizawa K, Shiota Y, Kagawa Y, Yamabe T
2562 - 2566	Infrared and ab initio study of the chloride-ammonia anion complex Weiser PS, Wild DA, Wolynec PP, Bieske EJ
2567 - 2572	Collisional energy transfer of NO D (2)Sigma(+) (upsilon ＇=0) and A (2)Sigma(+) (upsilon ＇=4) by O-2, N-2, Ar, and NO Luque J, Crosley DR
2573 - 2580	Oxygen diffusion in glassy polymer films: Effects of other gases and changes in pressure Poulsen L, Ogilby PR
2581 - 2586	Matrix effect on hydrogen atom tunneling: Comparison between hydrogen addition and abstraction Ichikawa T, Takahashi T, Koizumi H, Takada T
2587 - 2590	C-13-selective infrared multiple photon decomposition of beta-propiolactone, beta-butyrolactone, and diketene with a CO2 TEA laser Sugita K, Miyamoto Y, Arai S, Kuribayashi S, Majima T, Yamamoto S
2591 - 2598	Guest molecular motion of [N(CH3)(4)][Cd-3(CN)(7)] benzene, toluene, and ethylbenzene clathrates as studied by H-2 NMR Nishikiori S, Kitazawa T, Kim CH, Iwamoto T
2599 - 2612	Experimental and theoretical analysis of the vibrational spectra and theoretical study of the structures of 3,6-dichloropyridazine and 3,4,5-trichloropyridazine Vazquez J, Gonzalez JJL, Marquez F, Pongor G, Boggs JE
2613 - 2617	Ab initio study of peroxyacetic nitric anhydride and peroxyacetyl radical: Characteristic infrared band of peroxyacetyl radical Mhin BJ, Chang WY, Lee JY, Kim KS
2618 - 2625	Reactions of laser-ablated Cu with NO: Infrared spectra and density functional calculations of CuNO+, CuNO, Cu(NO)(2), and Cu(NO)(2)(-) in solid neon and argon Zhou MF, Andrews L
2626 - 2633	A spectroscopic study of solvent reorganization energy: Dependence on temperature, charge transfer distance, and the type of solute-solvent interactions Vath P, Zimmt MB
2634 - 2640	Quadricyclane radical cation Q(+): Formation and isomerization in liquid methylcyclohexane Buhler RE, Quadir MA
2641 - 2647	Cationization effect on the molecular weight distribution of an ethoxylated polymer: A combined theoretical and time-of-flight secondary ion mass spectroscopic study Cheng HS, Clark PAC, Hanton SD, Kung P
2648 - 2654	Experimental verification of theoretically calculated transition barriers of the reactions in a gaseous selective oxidation of CH4-O-2-NO2 Tabata K, Teng Y, Yamaguchi Y, Sakurai H, Suzuki E
2655 - 2662	Heterogeneous interactions of NO2 with aqueous surfaces Cheung JL, Li YQ, Boniface J, Shi Q, Davidovits P, Worsnop DR, Jayne JT, Kolb CE
2663 - 2667	Unusual temperature dependence of excited state proton transfer rates in alcohols Cohen B, Huppert D
2668 - 2680	Models for quantum effects in electron transfer: Co(Cp)(2)(+)vertical bar V(CO)(6)(-) Spears KG, Shang HR
2681 - 2688	Dynamics of argon collisions with water ice: Molecular beam experiments and molecular dynamics simulations Andersson PU, Nagard MB, Bolton K, Svanberg M, Pettersson JBC
2689 - 2694	Random chiral asymmetry generation by chiral autocatalysis in a far-from-equilibrium reaction system Asakura K, Ikumo A, Kurihara K, Osanai S, Kondepudi DK
2695 - 2705	Rate coefficients for reaction of OH with acetone between 202 and 395 K Wollenhaupt M, Carl SA, Horowitz A, Crowley JN
2706 - 2709	Reactions of H3O+(H2O)(n) with formaldehyde and acetaldehyde Midey AJ, Arnold ST, Viggiano AA
2710 - 2715	EPR kinetic evidence for radical intermediacy in the oxidation of secondary amines to nitrones by [Wo(O-2)(2)OCOC5H4N](-)[Bu4N+] Ballistreri FP, Bianchini R, Pinzino C, Tomaselli GA, Toscano RM
2716 - 2723	Local structure of phosphate/amine polyion complexes in phospholipid/polypeptide mixtures by solid state NMR and ab initio chemical shielding calculation Asakawa N, Sato D, Sakurai M, Inoue Y
2724 - 2728	A first-principles study of the structure and dynamics of C8H8, Si8H8, and Ge8H8 molecules Kilic C, Yildirim T, Mehrez H, Ciraci S
2729 - 2733	Ab initio calculations on reactions of CHF3 with its fragments Okamoto Y, Tomonari M
2734 - 2745	Structures, vibrational frequencies, and normal modes of substituted azo dyes: Infrared, Raman, and density functional calculations Biswas N, Umapathy S
2746 - 2751	Generalized simulated annealing studies on structures and properties of Ni-n (n=2-55) clusters Xiang Y, Sun DY, Gong XG
2752 - 2763	Linear free energy relationships for polyhalogenated alkane transformation by electron-transfer mediators in model aqueous systems Perlinger JA, Venkatapathy R, Harrison JF
2764 - 2771	Ab initio based configuration interaction study of the electronic states of InP Manna B, Dutta A, Das KK
2772 - 2779	Anharmonic vibrational spectroscopy of hydrogen-bonded systems directly computed from ab initio potential surfaces: (H2O)(n), n=2, 3; Cl-(H2O)(n), n=1, 2; H+(H2O)(n), n=1, 2; H2O-CH3OH Chaban GM, Jung JO, Gerber RB
2780 - 2787	alpha-substituted vinyl cations: Stabilities and electronic properties van Alem K, Lodder G, Zuilhof H
2788 - 2792	Ab initio calculations of spin-spin coupling constants in anhydrodeoxythymidines Czernek J, Lang J, Sklenar V
2793 - 2798	Catalytic-reactions of living polymers: Density functional study of reactivity of phenol and phenoxides with the cyclic tetramer of polycarbonate Ballone P, Montanari B, Jones RO
2799 - 2807	Theoretical study of the microsolvation of the bromide anion in water, methanol, and acetonitrile: Ion-solvent vs solvent-solvent interactions Ayala R, Martinez JM, Pappalardo RR, Marcos ES
2808 - 2823	2,2 ＇-bithiophene radical cation: An experimental and computational study Keszthelyi T, Grage MML, Offersgaard JF, Wilbrandt R, Svendsen C, Mortensen OS, Pedersen JK, Jansen HJA
2824 - 2833	Revised and expanded scale of gas-phase lithium cation basicities. An experimental and theoretical study Burk P, Koppel IA, Koppel I, Kurg R, Gal JF, Maria PC, Herreros M, Notario R, Abboud JLM, Anvia F, Taft RW
2834 - 2844	A Monte Carlo study of precision, bias, inconsistency, and non-Gaussian distributions in nonlinear least squares Tellinghuisen J
2845 - 2858	Infrared titration of aqueous sulfuric acid Max JJ, Menichelli C, Chapados C