Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.102, No.27 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (22 articles)

5157 - 5159	Diffusion-driven front instability in a three-dimensional medium Toth A, Veisz B, Horvath D
5160 - 5170	Exchange interaction in radical-triplet pairs : Evidences for CIDEP generation by level crossings in triplet-doublet interactions Kobori Y, Takeda K, Tsuji K, Kawai A, Obi K
5171 - 5174	Absolute intensities of nitric acid overtones Donaldson DJ, Orlando JJ, Amann S, Tyndall GS, Proos RJ, Henry BR, Vaida V
5175 - 5181	Existence of negative activation energies in simple bimolecular metathesis reactions and some observations on too-fast reactions Benson SW, Dobis O
5182 - 5188	Experimental and computational investigations of the reaction of OH with CF3I and the enthalpy of formation of HOI Berry RJ, Yuan J, Misra A, Marshall P
5189 - 5195	Gas-phase chemistry of the sulfur hexafluoride fragment ions SFn+ (n=0-5) and SFn2+ (n=2, 4). Ab initio thermochemistry of novel reactions of S+. and SF+ Sparrapan R, Mendes MA, Ferreira IPP, Eberlin MN, Santos C, Nogueira JC
5196 - 5205	Determination of rate coefficients for reactions of formaldehyde pyrolysis and oxidation in the gas phase Eiteneer B, Yu CL, Goldenberg M, Frenklach M
5206 - 5214	Effects of electronic structures on the excited-state intramolecular proton transfer of 1-hydroxy-2-acetonaphthone and related compounds Tobita S, Yamamoto M, Kurahayashi N, Tsukagoshi R, Nakamura Y, Shizuka H
5215 - 5219	Photoinduced electron transfer between C-60/C-70 and zinc tetraphenylporphyrin in polar solvents Nojiri T, Watanabe A, Ito O
5220 - 5227	Photocyclization of substituted allyl radicals and properties of the resulting cyclopropyl radicals Radzig VA, Ustynyuk LY, Osokina NY, Pergushov VI, Mel'nikov MY
5228 - 5235	Ab initio and density functional investigation of reactions of NO with XCO (X = H, F, Cl) Kulkarni SA, Koga N
5236 - 5240	Conformation and solvent dependence of the first molecular hyperpolarizability of pyridinium-N-phenoxide betaine dyes. Quantum chemical calculations Bartkowiak W, Lipinski J
5241 - 5252	Ab initio calculations of the structure, kinetics, and infrared laser chemical reaction dynamics of fluorooxirane Ha TK, Pochert J, Quack M
5253 - 5259	Theoretical study of the solvent effect on functional group properties and on the charge distribution and acidity of alkyl-substituted alcohols Safi B, Choho K, De Proft F, Geerlings P
5260 - 5262	C(6)0 topological isomers : Other carbon allotropes Dobrowolski JC, Mazurek AP
5263 - 5268	Comparative study of electron correlation and relativistic effects in CuF, AgF, and AuF Ilias M, Furdik P, Urban M
5269 - 5274	Correlated, static and dynamic polarizabilities of small molecules. Comparison of four "black box" methods Dalskov EK, Sauer SPA
5275 - 5279	Concentration effect on the absorption and emission spectra of the 9-oxa-2,3,4 ＇-methoxybenzobicyclo[4.3.0]non-1(6)-ene-7,8-dione : Self-associated dimer and excimer Dkaki M, Ait-Lyazidi S, Haddad M, Hnach M, Cazeau-Dubroca C, Aycard JP
5280 - 5289	Density functional study of ribose and deoxyribose chemical shifts Dejaegere AP, Case DA
5290 - 5297	Probing the limits of resonance stabilization. The case of linear polyacenes Notario R, Abboud JLM
5298 - 5304	Molecular structures and vibrational frequencies of iron carbonyls : Fe(CO)(5), Fe-2(CO)(9), and Fe-3(CO)(12) Jang JH, Lee JG, Lee H, Xie YM, Schaefer HF
5305 - 5311	On the mechanism of the spin-nonconserving chemical reaction O(P-3)+HCCH -> CH2((a)over-tilde(1)A(1))+CO(X-1 Sigma(+)). I. Feasibility Yarkony DR