Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.102, No.1 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (40 articles)

1 - 8	Kinetics and thermochemistry of the reversible combination reaction of the phenoxy radical with NO Berho F, Caralp F, Rayez MT, Lesclaux R, Ratajczak E
9 - 16	Caging and geminate recombination following photolysis of triiodide in solution Gershgoren E, Banin U, Ruhman S
17 - 30	Viscoelastic continuum model of nonpolar solvation. 1. Implications for multiple time scales in liquid dynamics Berg M
31 - 34	Nonconservation of spin in the reaction of CN with O-2 Phillips LF
35 - 44	Femtosecond transient absorption studies of trans- and cis-1,3,5-hexatriene in solution Ohta K, Naitoh Y, Tominaga K, Hirota N, Yoshihara K
45 - 50	Photochemical reactions of Rhodium(III) diimine complexes in solid glycerol matrixes. Thermal activation of a triplet dd level from a triplet pi pi* manifold Brozik JA, Crosby GA
51 - 59	Rotational state-specific dynamics of SiF C-2 Delta-B-2 Sigma(+) collision-induced transfer Jackson NA, Randall CJ, McKendrick KG
60 - 64	Reactions of O(P-3) with alkenes: H, CH2CHO, CO, and OH channels Quandt R, Min ZY, Wang XB, Bersohn R
65 - 81	Analysis of X-ray absorption spectra of some nickel oxycompounds using theoretical standards Mansour AN, Melendres CA
82 - 94	Density functional theory calculations of the structures, binding energies, and infrared spectra of methanol clusters Hagemeister FC, Gruenloh CJ, Zwier TS
95 - 101	Beam depletion spectroscopy of alkali atoms (Li, Na, K) attached to highly quantum clusters Callegari C, Higgins J, Stienkemeier F, Scoles G
102 - 110	Measurement and calculation of absolute rotational strengths for camphor, alpha-pinene, and borneol Bour P, McCann J, Wieser H
111 - 117	A precursor to the solvent radical cation MCH+: Pulse radiolysis of liquid methylcyclohexane (MCH) at 143 K Buhler RE, Katsumura Y
118 - 127	Intermolecular coupling in liquid and crystalline states of trans-N-methylacetamide investigated by polarized Raman and FT-IR spectroscopies Schweitzer-Stenner R, Sieler G, Mirkin NG, Krimm S
128 - 137	An experimental and theoretical study of jet-cooled complexes of chiral molecules: The role of dispersive forces in chiral discrimination Le Barbu K, Brenner V, Millie P, Lahmani F, Zehnacker-Rentien A
138 - 145	Magnetic circular dichroism of the CH radical in an argon matrix Langford VS, Williamson BE
146 - 152	Kinetics and mechanism of complex formation between Mg2+ and methylthymol blue Bremer C, Ruf H, Grell E
153 - 159	Measuring gas-phase chlorine atom concentrations: Rate constants for Cl+HN3, CF3I, and C2F5I Manke GC, Setser DW
160 - 167	Distance dependence of electronic coupling through trans alkyl chains: Effects of electron correlation Curtiss LA, Miller JR
168 - 172	Kinetics of the reactions of N(S-4) atoms with O-2 and CO2 over wide temperatures ranges Fernandez A, Goumri A, Fontijn A
173 - 180	Deliquescence behavior of multicomponent aerosols Ge ZZ, Wexler AS, Johnston MV
181 - 187	Calculation of rate constants for proton transfer between tethered oxygens Immaraporn B, Isaacson AD
188 - 191	Inhomogeneities of CSTR on a macroscale due to spatial dependence of micromixing time: The BZ reaction Strizhak P, Ali F, Menzinger M
192 - 199	Structure of concentrated HCl solutions Agmon N
200 - 213	Magnetic exchange between orbitally degenerate ions: A new development for the effective Hamiltonian Borras-Almenar JJ, Clemente-Juan JM, Coronado E, Palii AV, Tsukerblat BS
214 - 218	Low-lying electronic states of GeSe: Multireference singles and doubles configuration interaction study Manna B, Das KK
219 - 228	Hydration of beryllium, magnesium, calcium, and zinc ions using density functional theory Pavlov M, Siegbahn PEM, Sandstrom M
229 - 235	Theoretical study on the silylidyne insertion into NH3, H2O, HF, PH3, H2S, and HCl Wang ZX, Huang MB
236 - 241	Unimolecular decomposition pathways of dimethyl ether: An ab initio study Nash JJ, Francisco JS
242 - 247	Reaction-path dynamics in redundant internal coordinates Chuang YY, Truhlar DG
248 - 253	B3LYP, hybrid density functional studies of the durosemiquinone radical: The effect of symmetrical and asymmetrical hydrogen bonding on spin densities and hyperfine couplings O'Malley PJ
254 - 259	Ab initio molecular orbital calculations of the potential energy surfaces for the N(D-2)+CH4 reaction Kurosaki Y, Takayanagi T, Sato K, Tsunashima S
260 - 269	Intermolecular MH center dot center dot center dot HR bonding in monohydride Mo and W complexes Orlova G, Scheiner S
270 - 273	Reactions of HSCH2 radical with O-2, NO, and NO2: Ab initio calculations of enthalpies of reaction Trindle C, Romberg K
274 - 279	Intra- and intermolecular hydrogen bonding in 2-phosphinylphenol: A quantum chemical study Levy JB, Martin NH, Hargittai I, Hargittai M
280 - 284	Reduction potential of the tert-butylperoxyl radical in aqueous solutions Das TN, Dhanasekaran T, Alfassi ZB, Neta P
285 - 292	Potential energy function for intramolecular proton transfer reaction of glycine in aqueous solution Okuyama-Yoshida N, Nagaoka M, Yamabe T
293 - 300	On the reactivity of Ti+(F-4,F-2). Reaction of Ti+ with OH2 Irigoras A, Fowler JE, Ugalde JM
301 - 305	Effect of sodium perchlorate on the binding of 2-(4'-aminophenyl)- and 2-(4'-(N,N'-dimethylamino)phenyl)benzothiazole with beta-cyclodextrin in aqueous solution Dey J, Roberts EL, Warner IM
306 - 307	Comment on "Length scale for the constant pressure ensemble: Application to small systems and relation to Einstein fluctuation theory" Corti DS