Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.108, No.47 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (32 articles)

10381 - 10385	Virial expansion providing of the linearity for a unit compressibility factor Apfelbaum EM, Vorob'ev VS, Martynov GA
10386 - 10394	Reducing power of photogenerated alpha-hydroxy radicals. Proton-coupled electron transfer Shukla D, Young RH, Farid S
10395 - 10404	Experimental investigation by laser flash photolysis to reveal the optical and electron-donating properties of benzothiazole derivatives and a theoretical approach by using time-dependent density functional theory Pal SK, Sahu T, Misra T, Mallick PK, Paddon-Row MN, Ganguly T
10405 - 10413	Remarkable accelerating effects of ammonium cations on electron-transfer reactions of quinones by hydrogen bonding with semiquinone radical anions Okamoto K, Ohkubo K, Kadish KM, Fukuzumi S
10414 - 10425	Electron photodetachment from aqueous anions. 2. Ionic strength effect on geminate recombination dynamics and quantum yield for hydrated electron Sauer MC, Shkrob IA, Lian R, Crowell RA, Bartels DM, Chen XY, Suffern D, Bradforth SE
10426 - 10433	Conformational behavior of serine: An experimental matrix-isolation FT-IR and theoretical DFT(B3LYP)/6-31++G** study Lambie B, Ramaekers R, Maes G
10434 - 10440	Gas-phase reactions of O- and OH-containing cr cluster ions with ethylene molecules: Isolation of reaction sites of Cr-containing catalysts for ethylene polymerization Hanmura T, Ichihashi M, Monoi T, Matsuura K, Kondow T
10441 - 10447	Infrared spectroscopic studies of mono-, di-, and trihydrido C-H insertion complexes formed in reaction of ethylene with laser-ablated hafnium atoms and isolated in a solid argon matrix Cho HG, Andrews L
10448 - 10457	Gas-phase complexes containing the uranyl ion and acetone Van Stipdonk MJ, Chien W, Anbalagan V, Bulleigh K, Hanna D, Groenewold GS
10458 - 10463	Reactions of methyl- and ethylperoxy radicals with NO studied by time-resolved negative ionization mass spectrometry Xing JH, Nagai Y, Kusuhara M, Miyoshi A
10464 - 10472	Temperature-dependent kinetics of the gas-phase reactions of OH with Cl-2, CH4, and C3H8 Bryukov MG, Knyazev VD, Lomnicki SM, McFerrin CA, Dellinger B
10473 - 10485	Interaction of gas-phase ozone at 296 K with unsaturated self-assembled monolayers: A new look at an old system Dubowski Y, Vieceli J, Tobias DJ, Gomez A, Lin A, Nizkorodov SA, McIntire TM, Finlayson-Pitts BJ
10486 - 10490	Experimental and theoretical studies on the complex formed between H2S and O-2(-) Bell AJ, Wright TG
10491 - 10496	Effect of diffusional film on formation of hydrogen peroxide in photocatalytic reactions Shiraishi F, Kawanishi C
10497 - 10501	DAccurate determination of the absolute quantum yield for O(D-1) formation in the photolysis of ozone at 308 nm Takahashi K, Hayashi S, Suzuki T, Matsumi Y
10502 - 10508	Clusters of II-VI materials: CdiXi, X = S, Se, Te, i <= 16 Matxain JM, Mercero JM, Fowler JE, Ugalde JM
10509 - 10517	Electron delocalization in aminoguanidine: A computational study Bharatam PV, Iqbal P, Malde A, Tiwari R
10518 - 10526	Accurate energies and structures for large water clusters using the X3LYP hybrid density functional Su JT, Xu X, Goddard WA
10527 - 10534	AIM studies on reactions FNCX -> FXCN (X = O, S, and Se) Zeng YL, Zheng SJ, Meng LP
10535 - 10541	First-principles infrared spectrum of nitric acid and nitric acid monohydrate crystals Fernandez-Torre D, Escribano R, Archer T, Pruneda JM, Artacho E
10542 - 10550	Molecular modeling studies on the photochemical stability of azo dyes Morley JO, Guy OJ, Charlton MH
10551 - 10559	A solid-state NMR and computational study of sodium and potassium tetraphenylborates: Na-23 and K-39 NMR signatures for systems containing cation-pi interactions Wong A, Whitehead RD, Gan ZH, Wu G
10560 - 10564	Optimization of structures and LJ parameters of 1-chloro-1,2,2-trifluorocyclobutane and 1,2-dichlorohexafluorocyclobutane Saladino AC, Tang P
10565 - 10567	Electronic spectra and DFT calculations of hexanuclear chalcocyanide rhenium clusters Kozlova SG, Gabuda SP, Brylev KA, Mironov YV, Fedorov VE
10568 - 10577	Push-pull electronic effects in charge-transfer complexes: The case of N-H and N-Me lactams El Firdoussi A, Esseffar M, Bouab W, Abboud JLM, Mo O, Yanez M
10578 - 10585	Computational investigation of the solvation of nitric acid: Formation of the NO3- and H3O+ ion pair Scott JR, Wright JB
10586 - 10593	Direct combined ab initio/transition state theory study of the kinetics of the abstraction reactions of halogenated methanes with hydrogen atoms Louis F, Gonzalez CA, Sawerysyn JP
10594 - 10601	Jahn-Teller effect versus spin-orbit coupling in (XE)-E-2 CH3S: An ab initio study by the equation-of-motion coupled cluster method and multiconfiguration quasi-degenerate second-order perturbation theory Marenich AV, Boggs JE
10602 - 10608	Theoretical study on structures and Stabilities of [H-3,Si,C,N] isomers Wang Q, Ding YH, Sun CC
10609 - 10614	Key role of a threefold state crossing in the ultrafast decay of electronically excited cytosine Blancafort L, Robb MA
10615 - 10616	Comment on "Kinetics and mechanism of nitrite oxidation by HOBr/BrO- in atmospheric water and comparison with oxidation by HOCl/ClO-" Becker RH, Hartz KEH, Margerum DW
10617 - 10618	Reply to "Comment on'Kinetics and mechanism of nitrite oxidation by HOBr/BrO- in atmospheric water and comparison with oxidation by HOCI/CIO-" Lahoutifard N, Scott SL