Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.101, No.34 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (20 articles)

5963 - 5965	Autoionization-detected infrared spectroscopy of molecular ions Fujii A, Iwasaki A, Ebata T, Mikami N
5966 - 5968	A two-dimensional EPR nutation study on excited multiplet states of fullerene linked to a nitroxide radical Mizuochi N, Ohba Y, Yamauchi S
5969 - 5986	Translational activation of the S(N)2 nucleophilic displacement reactions Cl-+CH3Cl(CD3Cl)->ClCH3(ClCD3)+Cl-: A guided ion beam study DeTuri VF, Hintz PA, Ervin KM
5987 - 5996	Far infrared spectrum, ab initio calculations, and conformational analysis of 1-pentyne Bell S, Guirgis GA, Li Y, Durig JR
5997 - 6007	Conformational properties of nickel(II) meso-tetraphenylporphyrin in solution. Raman dispersion spectroscopy reveals the symmetry of distortions for a nonplanar conformer Unger E, Dreybrodt W, SchweitzerStenner R
6008 - 6014	Generation and 355 nm laser photodissociation of nitrous acid (HONO) and HONO-water clusters Ning CL, Pfab J
6015 - 6022	Ab initio energetic calculations of elementary reactions relevant to low-temperature silane oxidation by Gaussian-2 theory Kondo S, Tokuhashi K, Nagai H, Takahashi A, Kaise M, Sugie M
6023 - 6029	Observing unimolecular dissociation of metastable ions in FT-ICR: A novel application of the continuous ejection technique Lin CY, Chen Q, Chen HP, Freiser BS
6030 - 6042	Temperature coefficients of rates of ethyl radical reactions with HBr and Br in the 228-368 K temperature range at millitorr pressures Dobis O, Benson SW
6043 - 6047	Experimental and theoretical studies of the unimolecular decomposition of nitrosobenzene: High-pressure rate constants and the C-N bond strength Park J, Dyakov IV, Mebel AM, Lin MC
6048 - 6053	Basin-boundary crossing transitions in the bistable Belousov-Zhabotinsky reaction Ali F, Strizhak P, Menzinger M
6054 - 6062	Stability and fragmentation of protonated helium dimers from ab initio calculations of their potential energy surfaces Baccarelli I, Gianturco FA, Schneider F
6063 - 6068	Theoretical investigations on heterogeneous Ziegler-Natta catalyst supports: Stability of the electron donors at different coordination sites of MgCl2 Puhakka E, Pakkanen TT, Pakkanen TA
6069 - 6076	Mechanism of the vanadium oxide-catalyzed selective reduction of NO by NH3. A quantum chemical modeling Gilardoni F, Weber J, Baiker A
6077 - 6091	Theoretical study of the reaction CH(X-2 Pi)+NO(X-2 Pi) .1. Determination of some reaction paths in the lowest triplet potential energy surface Marchand N, Jimeno P, Rayez JC, Liotard D
6092 - 6100	Nature of the transition structure for alkene epoxidation by peroxyformic acid, dioxirane, and dimethyldioxirane: A comparison of B3LYP density functional theory with higher computational levels Bach RD, Glukhovtsev MN, Gonzalez C, Marquez M, Estevez CM, Baboul AG, Schlegel HB
6101 - 6106	Theoretical investigation of electronic structure and nuclear quadrupole interactions in cocaine free base Pati R, Das TP, Sahoo N, Ray SN
6107 - 6117	Intramolecular hydrogen bonding, gauche interactions, and thermodynamic functions of 1,2-ethanediamine, 1,2-ethanediol, and 2-aminoethanol: A global conformational analysis Chang YP, Su TM, Li TW, Chao I
6118 - 6124	Self-aggregation of cationic porphyrins in water. Can pi-pi stacking interaction overcome electrostatic repulsive force? Kano K, Minamizono H, Kitae T, Negi S
6125 - 6131	Theoretical study of cation/ether complexes: The alkali metals and dimethyl ether Hill SE, Glendening ED, Feller D