Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.103, No.46 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (31 articles)

9163 - 9166	Hydrogen bond strength and acidity. Structural and energetic correlations for acetylides and alcohols Chabinyc ML, Brauman JI
9167 - 9173	Hole transfer equilibrium in rigidly linked bichromophoric molecules Chen L, Qi N, Houmam A, Wayner DDM, Weininger SJ, McGimpsey WG
9174 - 9183	Nanosecond laser flash photolysis and steady-state photolysis studies of benzyltrimethylsilane and trimethylsilyldiphenylmethane Hiratsuka H, Kobayashi S, Minegishi T, Hara M, Okutsu T, Murakami S
9184 - 9189	Evidence for pi-pi interactions in the S-1 state of zinc porphyrin dimers revealed by picosecond time-resolved resonance Raman spectroscopy Nakashima S, Taniguchi S, Okada T, Osuka A, Mizutani Y, Kitagawa T
9190 - 9194	Structure and energetics of vinoxide and the X((2)A") and A((2)A') vinery radicals Alconcel LS, Deyerl HJ, Zengin V, Continetti RE
9195 - 9203	Penning ionization electron spectroscopic and ab initio, study of the interaction and ionization of HNCO and HNCS with He*(2(3)S) metastable and Li(2(2)S) ground state atoms Pasinszki T, Kishimoto N, Ohno K
9204 - 9210	Conformational dynamics of 5,11,17,23,-tetra-p-tert-butyl-25,27-di(N,N-diethylaminocarbonyl)methoxy-26,28-dimethoxycalix[4]arene and its kinetics and mechanisms of the cesium cation complexation in solution studied by H-1, C-13, and Cs-133 NMR spectroscopy Meier UC, Detellier C
9211 - 9220	Static SIMS studies of reactions on mimics of polar stratospheric clouds III: Mechanism of chlorine nitrate decomposition and reaction Donsig HA, Herridge D, Vickerman JC
9221 - 9229	Mass-independent oxygen isotope (O-16, O-17, O-18) fractionation found in H-x, O-x reactions Savarino J, Thiemens MH
9230 - 9240	Atmospheric oxidation of fluorinated ethers, E143a (CF3OCH3), E134 (CHF2OCHF2), and E125 (CHF2OCF3) Good DA, Kamboures M, Santiano R, Francisco JS
9241 - 9251	Direct observation of hydrogen atom adducts to nitromethane and methyl nitrite. A variable-time neutralization-reionization mass spectrometric and ab initio/RRKM study Polasek M, Turecek F
9252 - 9258	The gas-phase kinetics of reactions of alkali metal atoms with nitric oxide Goumri A, Rocha JDR, Misra A, Marshall P
9259 - 9265	Heterogeneous chemistry of acetone in sulfuric, acid solutions: Implications for the upper troposphere Kane SM, Timonen RS, Leu MT
9266 - 9274	Structure of cationized arginine (Arg center dot M+, M = H, Li, Na, K, Rb, and Cs) in the gas phase: Further evidence for zwitterionic arginine Jockusch RA, Price WD, Williams ER
9275 - 9279	Equilibrium structure and stability of AlCn (n=2, 3) and AlCnN (n=1, 2) species Zheng XG, Wang ZH, Tang AC
9280 - 9284	Effect of para substituents on the molecular and electronic structures of sterically congested triplet diphenylcarbenes Hu YM, Hirai K, Tomioka H
9285 - 9289	Reduction behavior of the early actinyl ions in aqueous solution Vallet V, Maron L, Schimmelpfennig B, Leininger T, Teichteil C, Gropen O, Grenthe I, Wahlgren U
9290 - 9295	Adjusted connection atoms for combined quantum mechanical and molecular mechanical methods Antes I, Thiel W
9296 - 9306	Thermochemical characterization of seaborgium compounds in gas adsorption chromatography Eichler B, Turler A, Gaggeler HW
9307 - 9312	Validity of the minimum polarizability principle in molecular vibrations and internal rotations: An ab initio SCF study Chattaraj PK, Fuentealba P, Jaque P, Toro-Labbe A
9313 - 9322	Valence state atoms in molecules. 5. Universal scaling of the inner branch of fifty RKR potential energy curves. Comparison of the valence state, Morse, and Rydberg curves Gardner DON, von Szentpaly L
9323 - 9329	Ab initio molecular orbital study of the N(D-2)+HCN((1)Sigma) reaction Kurosaki Y, Takayanagi T
9330 - 9335	Intramolecular dihydrogen bonding in main group elements. Connection with dehydrogenation reactions Kulkarni SA
9336 - 9344	Enthalpies of formation of N-substituted pyrazoles and imidazoles Mo O, Yanez M, Roux MV, Jimenez P, Davalos JZ, da Silva MAVR, da Silva MDMCR, Matos MAR, Amaral LMPF, Sanchez-Migallon A, Cabildo P, Claramunt R, Elguero J, Liebman JF
9345 - 9348	Steric course and mechanism of the water exchange of the Ruthenium(III) aqua pentaammine ion Rotzinger FP
9349 - 9354	Intersystem crossings in model energetic materials Manaa MR, Fried LE
9355 - 9358	A density functional theory study of the gas-phase hydrolysis of dinitrogen pentoxide Snyder JA, Hanway D, Mendez J, Jamka AJ, Tao FM
9359 - 9363	Electronic and geometrical structure of the Sc[BO](+) cation. An ab initio investigation Papakondylis A, Mavridis A
9364 - 9369	The radical transformation in artemisinin: A DFT study Gu JD, Chen KX, Jiang HL, Leszczynski J
9370 - 9377	An efficient deformation-based global optimization method (self-consistent basin-to-deformed-basin mapping (SCBDBM)). Application to Lennard-Jones atomic clusters Pillardy J, Liwo A, Scheraga HA
9378 - 9382	Ground and triplet excited structures and spectroscopic properties of halogenated zinc meso-tetraphenylporphyrin Nguyen KA, Day PN, Pachter R