Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.112, No.18 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (31 articles)

4165 - 4169	Photophysical properties of sulfortated dihydroxy phosphorus(V) tetrabenzotriazacorrole Huang L, Zhao P, Li ZY, Zhang FS, Tung CH
4170 - 4175	Ultrafast dynamics of the carbonyl stretching vibration in acetic acid in aqueous solution studied by sub-picosecond infrared spectroscopy Banno M, Ohta K, Tominaga K
4176 - 4185	Direct dynamics study of the hydrogen-abstraction reaction of 1,1,2,2,3-fluorinated propane with the hydroxyl radical Gao H, Wang Y, Liu JY, Yang L, Li ZS, Sun CC
4186 - 4193	Experimental and theoretical analysis of the reorientational dynamics of fullerene C-70 in various aromatic solvents Hughes RM, Mutzenhardt P, Bartolotti L, Rodriguez AA
4194 - 4201	Intersystem crossing mediated by photoinduced intramolecular charge transfer: Julolidine-anthracene molecules with perpendicular pi systems Dance ZEX, Mickley SM, Wilson TM, Ricks AB, Scott AM, Ratner MA, Wasielewski MR
4202 - 4208	Geometric and chelation influences on the electronic structure and optical properties of tetra(carboxylic acid)phenyleneethynylene dyes Berlin A, Risko C, Ratner MA
4209 - 4214	Evidence for emergent chemical bonding in Au+-Rg complexes (Rg = Ne, Ar, Kr, and Xe) Breckenridge WH, Ayles VL, Wright TG
4215 - 4223	Entropic changes control the charge separation process in triads mimicking photosynthetic charge separation Rizzi AC, van Gastel M, Liddell PA, Palacios RE, Moore GF, Kodis G, Moore AL, Moore TA, Gust D, Braslavsky SE
4224 - 4234	Effective two-photon absorption cross section of heteroaromatic quadrupolar dyes: Dependence on measurement technique and laser pulse characteristics Signorini R, Ferrante C, Pedron D, Zerbetto M, Cecchetto E, Slaviero M, Fortunati I, Collini E, Bozio R, Abbotto A, Beverina L, Pagani GA
4235 - 4240	Is a proposed reaction mechanism free from unnecessary assumptions? Occam's razor applied in a mathematical way to complex first-order reaction systems Bergson G, Linderberg J
4241 - 4245	Chemical oscillations and waves in the catalyzed bromate-pyrocatechol reaction Harati M, Wang JC
4246 - 4253	Homogeneous decomposition mechanisms of diethylzine by Raman spectroscopy and quantum chemical calculations Kim YS, Won YS, Hagelin-Weaver H, Omenetto N, Anderson T
4254 - 4260	Coherence quantum beats in two-dimensional electronic spectroscopy Cheng YC, Fleming GR
4261 - 4270	Kinetics and mechanism of the sonolytic conversion of the aqueous perfluorinated surfactants, perfluorooctanoate (PFOA), and perfluorooctane sulfonate (PFOS) into inorganic products Vecitis CD, Park H, Cheng J, Mader BT, Hoffmann MR
4271 - 4276	Oscillations in the concentration of fluoride ions induced by a pH oscillator Horvath V, Kurin-Csorgei K, Epstein IR, Orban M
4277 - 4283	Molecular structure and dynamics in the low temperature (orthorhombic) phase of NH3BH3 Cho H, Shaw WJ, Parvanov V, Schenter GK, Karkamkar A, Hess NJ, Mundy C, Kathmann S, Sears J, Lipton AS, Ellis PD, Autrey ST
4284 - 4293	Free radical conformations and conversions in X-irradiated single crystals of L-cysteic acid by electron magnetic resonance and density functional theory studies Ohman KT, Sagstuen E
4294 - 4307	Solvation oscillations and excited-state dynamics of 2-amino- and 2-hydroxy-7-nitrofluorene and its 2'-deoxyriboside Karunakaran V, Pfaffe M, Ioffe I, Senyushkina T, Kovalenko SA, Mahrwald R, Fartzdinov V, Sklenar H, Ernsting NP
4308 - 4313	Nonequilibrium thermodynamics formalism for Marcus theory of heterogeneous and self-exchange electron-transfer rate constants Sethi R, Sangaranarayanan MV
4314 - 4323	Density functional theory study on OH-Initiated atmospheric oxidation of m-xylene Fan JW, Zhang RY
4324 - 4335	Calculation of vibrational transition frequencies and intensities in water dimer: Comparison of different vibrational approaches Kjaergaard HG, Garden AL, Chaban GM, Gerber RB, Matthews DA, Stanton JF
4336 - 4341	Density functional study of adenine tetrads with N6-H6 center dot center dot center dot N3 hydrogen bonds Meyer M, Suhnel J
4342 - 4354	Ab initio study of hydrogen-bond formation between aliphatic and phenolic hydroxy groups and selected amino acid side chains Nagy PI, Erhardt PW
4355 - 4359	Tautomeric and conformational properties of malonamic acid methyl ester, NH2C(O)-CH2-C(O)OCH3: Electron diffraction and quantum chemical study Belova NV, Oberhammer H, Shlykov SA
4360 - 4366	Conformational stability of 1-butene: An electron momentum spectroscopy investigation Wu F, Chen XJ, Shan X, Tian SX, Li ZJ, Xu KZ
4367 - 4374	Theoretical study of 5-aminolevulinic acid tautomerization: A novel self-catalyzed mechanism Erdtman E, Eriksson LA
4375 - 4381	Geometries and stabilities of the carbon clusters with the rhodium impurity: A computational investigation Jia LC, Zhao RN, Han JG, Sheng LS, Cai WP
4382 - 4385	A simple method for estimating the superaromatic stabilization energy of a super-ring molecule Aihara JI
4386 - 4393	CLOPPA-IPPP analysis of cooperative effects in hydrogen-bonded molecular complexes. Application to intermolecular (2h)J(N,C) spin-spin coupling constants in linear (CNH)(n) complexes Giribet CG, de Azua MCR
4394 - 4398	Low-lying singlet and triplet electronic states of RhB Borin AC, Gobbo JP
4399 - 4404	Theoretical study on the electronic states of formylcarbene (HC center dot CHO) and triplet ketene (H-2 CCO) and the ultraviolet absorption spectra attributable to these molecules Chaudhuri RK, Krishnamachari SLNG