Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.108, No.13 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (30 articles)

2363 - 2369	Picosecond relaxation of (MLCT)-M-3 excited states of [Re(Etpy)(CO)(3)(dmb)](+) and [Re(Cl)(CO)(3)(bpy)] as revealed by time-resolved resonance raman, UV-vis, and IR absorption spectroscopy Liard DJ, Busby M, Matousek P, Towrie M, Vlcek A
2370 - 2374	Global analysis of kinetic and stationary diffusion-mediated fluorescence quenching data Klos J, Molski A
2375 - 2381	Competitive electron transfer from the S-2 and S-1 excited states of zinc meso-tetraphenylporphyrin to a covalently bound pyromellitimide: Dependence on donor-acceptor structure and solvent Hayes RT, Walsh CJ, Wasielewski MR
2382 - 2388	Vibrational relaxation of SO(X-3 Sigma, v=1-5) and nascent vibrational distributions of SO generated in the photolysis of SO2 at 193.3 nm Yamasaki K, Taketani F, Sugiura K, Tokue I, Tsuchiya K
2389 - 2401	Vibrational energy relaxation of the OH stretch in liquid methanol Gulmen TS, Sibert EL
2402 - 2404	Nanosecond dynamics of single-molecule fluorescence resonance energy transfer Ariunbold GO, Agarwal GS, Wang Z, Scully MO, Walther H
2405 - 2410	Time-resolved surface temperature measurement of MALDI matrices under pulsed UV laser irradiation Koubenakis A, Frankevich V, Zhang J, Zenobi R
2411 - 2417	Two-dimensional FT-NIR correlation study of hydrogen bonding in the butan-1-ol/water system Czarnecki MA, Wojtkow D
2418 - 2425	Sn2BrxI4-x(g) and Sn2BryI3-y+ (x=0-4, y=0-3) species: Mass spectrometric evidence and quantum-chemical studies Saloni J, Roszak S, Miller M, Hilpert K, Leszczynski J
2426 - 2430	Generation of neutral CCCCBO in the gas phase from [CCCCBO](-) and rearrangement of energized CCCCBO to OCCCCB: A joint experimental and theoretical investigation McAnoy AM, Dua S, Schroder D, Bowie JH, Schwarz H
2431 - 2435	Matrix isolation infrared spectroscopic and theoretical study of transition metal dioxide-acetylene complexes Zhou MF, Dong J, Miao L
2436 - 2442	Dynamical response and firing patterns in periodically pulsed bromate-sulfite-ferrocyanide system Pesek O, Kaspar P, Schreiberova L, Schreiber I
2443 - 2450	A shock-tube, laser-schlieren study of the dissociation of 1,1,1-trifluoroethane: An intrinsic non-RRKM process Kiefer JH, Katopodis C, Santhanam S, Srinivasan NK, Tranter RS
2451 - 2456	Formation of O(P-3) atoms in the photolysis of N2O at 193 nm and O(P-3)+N2O product channel in the reaction of O(D-1)+N2O Nishida S, Takahashi K, Matsumi Y, Taniguchi N, Hayashida S
2457 - 2463	Oxyhalogen-sulfur chemistry: Nonlinear oxidation kinetics of hydroxymethanesulfinic acid by acidic iodate Ojo JF, Otoikhian A, Olojo R, Simoyi RH
2464 - 2468	Ab initio study of the interaction hyperpolarizabilities of H-bond dimers between two pi-systems Wang BQ, Li ZR, Wu D, Hao XY, Li RJ, Sun CC
2469 - 2474	A topological study of the transition states of the hydrogen exchange and dehydrogenation reactions of ethane on a zeolite cluster Okulik NB, Diez RP, Jubert AH
2475 - 2486	Benchmark results for hydrogen atom transfer between carbon centers and validation of electronic structure methods for bond energies and barrier heights Dybala-Defratyka A, Paneth P, Pu JZ, Truhlar DG
2487 - 2491	Is the Fukui function a right descriptor of hard-hard interactions? Melin J, Aparicio F, Subramanian V, Galvan M, Chattaraj PK
2492 - 2498	Exploring hydration patterns of aldehydes and amides: Ab initio investigations Kulkarni AD, Babu K, Gadre SR, Bartolotti LJ
2499 - 2507	Application of a lumped-inertia technique to vibrational analysis of the torsional-twisting modes of low molecular weight polyphenylenes and polyethynylphenylenes Zheng MG, Vedova-Brook N, Sohlberg K
2508 - 2513	Theoretical enthalpies of formation and O-H bond dissociation enthalpy of an ubiquinol model and its free radical Espinosa-Garcia J
2514 - 2519	Theoretical studies of the interaction of water with compensatory and noncompensatory solutes for proteins Maclagan RGAR, Malardier-Jugroot C, Whitehead MA, Lever M
2520 - 2526	Free energy profile of the reaction between the hydroxide ion and ethyl acetate in aqueous and dimethyl sulfoxide solutions: A theoretical analysis of the changes induced by the solvent on the different reaction pathways Pliego JR, Riveros JM
2527 - 2535	CH center dot center dot center dot F hydrogen bonds. Dimers of fluoromethanes Kryachko E, Scheiner S
2536 - 2544	Spectroscopic and density functional theory studies of 1,10-phenanthroline, its radical anion, and [Cu(Phen)(PPh3)(2)](+) Howell SL, Gordon KC
2545 - 2549	Class IV charge model for the self-consistent charge density-functional tight-binding method Kalinowski JA, Lesyng B, Thompson JD, Cramer CJ, Truhlar DG
2550 - 2554	Tests of the MP2 model and various DFT models in predicting the structures and B-N bond dissociation energies of amine-boranes (X3C)(m)H3-mB-H(CH3)(n)H3-n (X = H, F; m=0-3; n=0-3): Poor preformance of the B3LYP approach for dative B-N bonds Gilbert TM
2555 - 2558	Isomer stability of N-24, N-30, and N-36 cages: Cylindrical versus spherical structure Strout DL
2559 - 2566	Effect of pressure on the proton-transfer rate from a photoacid to a solvent. 2. 2-Naphthol-6-sulfonate in water Leiderman P, Genosar L, Koifman N, Huppert D