Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.112, No.23 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (38 articles)

5025 - 5027	Vibrational characterization of the 1 : 1 iodine-benzene complex isolated in solid krypton Kiviniemi T, Hulkko E, Kijunen T, Pettersson M
5028 - 5033	Bonding of benzene with excited states of Fe-7 Valencia I, Chavez V, Castro M
5034 - 5039	Accurate determination of the limiting anisotropy of rhodamine 101. Implications for its use as a fluorescence polarization standard Prazeres TJV, Fedorov A, Barbosa SP, Martinho JMG, Berberan-Santos MN
5040 - 5045	Coherence length determination of meso-meso linked porphyrin arrays based on forward-backward pair trajectory analysis Lee M, Kim H, Kim D, Sim E
5046 - 5053	Electronic states of o-nitrobenzaldehyde: A combined experimental and theoretical study Leyva V, Corral I, Schmierer T, Heinz B, Feixas F, Migani A, Blancafort L, Gilch P, Gonzalez L
5054 - 5059	Excited-state dynamics of polyfluorene derivatives in solution Simas ER, Gehlen MH, Glogauer A, Akcelrud L
5060 - 5063	Ionization spectroscopy of conformational isomers of propanal: The origin of the conformational preference Choi S, Kang TY, Choi KW, Han S, Ahn DS, Baek SJ, Kim SK
5064 - 5073	PELDOR measurements on a nitroxide-labeled Cu(II) porphyrin: Orientation selection, spin-density distribution, and conformational flexibility Bode BE, Plackmeyer J, Prisner TF, Schiemann O
5074 - 5084	Photophysical properties of oligophenylene ethynylenes modified by donor and/or acceptor groups Yamaguchi Y, Shimoi Y, Ochi T, Wakamiya T, Matsubara Y, Yoshida ZI
5085 - 5095	The temperature and pressure dependence of the reactions H+O-2(+M)-> HO2(+M) and H+OH(+M)-> H2O(+M) Sellevag SR, Georgievskii Y, Miller JA
5096 - 5103	Photoresponsive europium(III) complex based on photochromic reaction Nakagawa T, Hasegawa Y, Kawai T
5104 - 5112	Vibrational spectral diffusion and hydrogen bond dynamics in heavy water from first principles Mallik BS, Semparithi A, Chandra A
5113 - 5120	Formation of neutral methylcarbamic acid (CH3NHCOOH) and methylammonium methylcarbamate [CH3NH3+][CH3NHCO2-] at low temperature Bossa JB, Borget F, Duvernay F, Theule P, Chiavassa T
5121 - 5125	IR-UV double resonance spectroscopic investigation of phenylacetylene-alcohol complexes. Alkyl group induced hydrogen bond switching Singh PC, Patwari GN
5126 - 5130	Infrared spectroscopic investigation of CO adsorption on SBA-15- and KIT-6-supported nickel phosphide hydrotreating catalysts Koranyi TI, Pfeifer E, Mihaly J, Fottinger K
5131 - 5137	Evolution of the reaction mechanism during ultrafast photoinduced electron transfer Kuzmin MG, Soboleva IV, Dolotova EV
5138 - 5151	Photoionization of atmospheric aerosol constituents and precursors in the 7-15 eV energy region: Experimental and theoretical study Gaie-Levrel F, Gutle C, Jochims HW, Ruehl E, Schwell M
5152 - 5158	Temperature dependence of the evaporation coefficient of water in air and nitrogen under atmospheric pressure: Study in water droplets Zientara M, Jakubezyk D, Kolwas K, Kolwas M
5159 - 5166	Arsenate incorporation in gypsum probed by neutron, X-ray scattering and density functional theory modeling Fernandez-Martinez A, Cuello GJ, Johnson MR, Bardelli F, Roman-Ross G, Charlet L, Turrillas X
5167 - 5174	Probing the flexibility of internal rotation in silylated phenols with the NMR scalar spin-spin coupling constants Sychrovsky V, Benda L, Prokop A, Blechta V, Schraml J, Spirko V
5175 - 5186	Spatial ring current model for the prismane molecule Pelloni S, Lazzeretti P
5187 - 5197	Radial exchange density and electron delocalization in molecules Geier J
5198 - 5207	Two-photon absorption properties of azulenyl compounds having a conjugated ketone backbone Hirakawa S, Kawamata J, Suzuki Y, Tani S, Murafuji T, Kasatani K, Antonov L, Kamada K, Ohta K
5208 - 5217	Quantum-chemical foundations of the topological substructural molecular design Estrada E
5218 - 5223	A theoretical study of pericyclic rearrangements catalyzed by lithium Montero-Campillo MM, Cabaleiro-Lago EM, Rodriguez-Oterot J
5224 - 5235	Computational study of the aminolysis of anhydrides: Effect of the catalysis to the reaction of succinic anhydride with methylamine in gas phase and nonpolar solution Petrova T, Okovytyy S, Gorb L, Leszczynski J
5236 - 5242	Relativistic model core potential study of the Au+Xe system Zeng T, Klobukowski M
5243 - 5250	Molecular structure of 1,5-diazabicyclo[3.1.0]hexane as determined by gas electron diffraction and quantum-chemical calculations Vishnevskiy YV, Vogt N, Vogt J, Rykov AN, Kuznetsov VV, Makhova NN, Vilkov LV
5251 - 5257	Theoretical study on reaction mechanism of fulminic acid HCNO with CN radical Pang JL, Xie HB, Zhang SW, Ding YH, Tang AQ
5258 - 5263	Influence of substitution, hybridization, and solvent on the properties of C-HO single-electron hydrogen bond in CH3-H2O complex An XL, Liu HP, Li QZ, Gong BA, Cheng JB
5264 - 5268	Water as a clustering agent in photolysis and photonucleation of benzaldehyde vapor Dultseva GG, Dubtsov SN, Dultsev FN
5269 - 5277	Carbene proton attachment energies: Theoretical study Azenkeng A, Laumb JD, Jensen RR, Olson ES, Benson SA, Hoffmann MR
5278 - 5285	Interplay of hydrogenation and dehydrogenation in isoindoline and indoline isomers: A density functional theory study Tsai HHG, Chung MW, Chou YK, Hou DR
5286 - 5294	Modeling pi-pi interactions with the effective fragment potential method: The benzene dimer and substituents Smith T, Slipchenko LV, Gordon MS
5295 - 5299	Theoretical study on mechanisms and kinetics of NCCO+O-2 reaction Tang YZ, Wang RS, Wang BS
5300 - 5304	Theoretical study of the mechanism, of the abstraction reactions of heavy cyclopropenes by alcohol Hsiao J, Lan CY, Su MD
5305 - 5311	Macrocyclic conjugation pathways in porphyrins Aihara JI
5312 - 5321	Gas-phase reactions of Co+ with ethylamine: A theoretical approach to the reaction mechanisms of transition metal ions with primary amines Lu XQ, Guo WY, Yang TF, Zhao LM, Du SC, Wang L, Shan HH