Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.108, No.25 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (26 articles)

5295 - 5298	Tracking waves and spiral drift in reaction-diffusion systems with finite bandwidth dispersion relations Manz N, Steinbock O
5299 - 5307	A study of the thermal decomposition of 2-azidoacetamide by ultraviolet photoelectron spectroscopy and matrix-isolation infrared spectroscopy: Identification of the imine intermediate H2NCOCHNH Dyke JM, Levita G, Morris A, Ogden JS, Dias AA, Algarra M, Santos JP, Costa ML, Rodrigues P, Barros MT
5308 - 5314	Investigation of excited-state proton transfer in 2-naphthol derivatives included in Langmuir-Blodgett films Mironczyk A, Jankowski A, Chyla A, Ozyhar A, Dobryszycki P
5315 - 5321	Turing patterns, spatial bistability, and front instabilities in a reaction-diffusion system Szalai I, De Kepper P
5322 - 5332	Density-functional study on the structures, stabilities, and dissociation pathways of Sc3+(DMSO)(n) complexes (n=1-6) Xiao CY, Hagelberg F, El-Nahas AM
5333 - 5337	Cavity ring-down laser absorption spectroscopy of the E-3 Delta-X-3 Delta transition of VN Ma TM, Leung JWH, Cheung ASC
5338 - 5352	A comparative study of overtone CH-stretching vibrational circular dichroism spectra of fenchone and camphor Longhi G, Gangemi R, Lebon F, Castiglioni E, Abbate S, Pultz VM, Lightner DA
5353 - 5364	Conformational studies of fluoromethylcyclopropane from temperature-dependent FT-IR spectra of xenon solutions and ab initio calculations Durig JR, Yu ZH, Zheng C, Guirgis GA
5365 - 5376	Infrared optical constants for carvone from the mie inversion of aerosol extinction spectra Dohm MT, Potscavage AM, Niedziela RF
5377 - 5385	Mechanistic investigations of the BZ reaction with oxalic acid substrate. I. The oscillatory parameter region and rate constants measured for the reactions of HOBr, HBrO2, and acidic BrO3- with oxalic acid Pelle K, Wittmann M, Lovrics K, Noszticzius Z, Liveri MLT, Lombardo R
5386 - 5392	Photochemistry of butyrophenone: Combined complete-active-space self-consistent field and density functional theory study of Norrish type I and II reactions He HY, Fang WH, Phillips DL
5393 - 5398	Large long-range F-F indirect spin-spin coupling constants. Prediction of measurable F-F couplings over a few nanometers Provasi PF, Aucar GA, Sauer SPA
5399 - 5407	Polycyclic aromatic hydrocarbons with five-membered rings: Distributions within isomer families in experiments and computed equilibria Marsh ND, Wornat MJ
5408 - 5416	Monte Carlo Bohmian dynamics from trajectory stability properties Liu J, Makri N
5417 - 5423	Ab initio molecular orbital investigation of a precursor in ethylene biosynthesis: Proton transfer in a cluster of 1-aminocyclopropane-1-carboxylic acid and water Ito M, Re S, Tokiwa H
5424 - 5430	Dynamic study of O-2 adsorption and dissociation on Pd low-index surfaces Wang ZX, Jia XF, Wang R
5431 - 5437	Vibrational spectrum and thermochemistry of the formyl (HCO) radical: A variational study by the coupled cluster CCSD(T) method with complete basis set extrapolation Marenich AV, Boggs JE
5438 - 5448	Structural dependence of NH stretch mode frequency shifts in amide and peptide Mirkin NG, Krimm S
5449 - 5453	Miscibility of zinc chalcogenides Janetzko F, Jug K
5454 - 5463	Combining self-consistent-charge density-functional tight-binding (SCC-DFTB) with molecular mechanics by the generalized hybrid orbital (GHO) method Pu JZ, Gao JL, Truhlar DG
5464 - 5467	Theoretical study of Ar-CoCO Ono Y, Taketsugu T
5468 - 5473	Three-dimensional generalized graph matrix, Harary descriptors, and a generalized interatomic Lennard-Jones potential Estrada E
5474 - 5478	Molecular structures of trimethylchlorogermane, (CH3)(3)GeCl, and trimethylbromogermane, (CH3)(3)GeBr, obtained by gas-phase electron diffraction and theoretical calculations Aarset K, Page EM
5479 - 5483	Validation of exchange - Correlation functionals for spin states of iron complexes Swart M, Groenhof AR, Ehlers AW, Lammertsma K
5484 - 5489	ESR investigation of chemical exchange in geminally diphosphorylated linear nitroxide radicals Rockenbauer A, Olive G, Rozanska X, Jacques A, Gigmes D, Le Moigne FO, Peeters D, German A, Tordo P
5490 - 5502	Electron photodetachment from aqueous anions. 1. Quantum yields for generation of hydrated electron by 193 and 248 nm laser photoexcitation of miscellaneous inorganic anions Sauer MC, Crowell RA, Shkrob IA