Journal of Chemical Physics

Journal of Chemical Physics, Vol.117, No.13 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (51 articles)

5959 - 5962	Electronic confinement of organic molecules in confined spaces: A spectroscopic study of Zn(phen)(2)(NO3)(2) loaded MCM-41 Zhang LZ, Cheng P, Liao DZ
5963 - 5966	Hyper-Rayleigh scattering from silver nanoparticles Hao EC, Schatz GC, Johnson RC, Hupp JT
5967 - 5970	Electron stimulated solvation and reaction of water, ammonia, and methane in nanoclusters adsorbed on solid Ar substrate Souda R
5971 - 5977	Wavelet formulation of path integral Monte Carlo Cho AE, Doll JD, Freeman DL
5978 - 5987	A geminal model chemistry Rassolov VA
5988 - 5997	Semiclassical initial value representation propagation of vibrational wave functions Sklarz T, Kay KG
5998 - 6009	Spin-spin coupling tensors by density-functional linear response theory Lantto P, Vaara J, Helgaker T
6010 - 6015	A density functional study of van der Waals interactions Kamiya M, Tsuneda T, Hirao K
6016 - 6021	Correspondence between configurational temperature and molecular kinetic temperature thermostats Delhommelle J, Evans DJ
6022 - 6031	Extremal path approach to rate constant calculations by the linearized semiclassical initial value representation Smedarchina Z, Fernandez-Ramos A
6032 - 6037	Isotope effects in linear dihydrogen bonded complexes containing LiH McDowell SAC, Forde TS
6038 - 6046	Photodissociation of CFX = CHCl (X=H,F) at 193 nm by product translational spectroscopy Ko HS, Lee YR, Chen CC, Wang LD, Lin SM
6047 - 6053	Charge transfer and nonadiabatic dynamics of diatomic anions in clusters Cho E, Shin S
6054 - 6060	The observation of large changes in the rotational constants of glyoxal in superfluid helium droplets upon electronic excitation Portner N, Toennies JP, Vilesov AF
6061 - 6070	Photoinduced reactions in the Mg+-NHn(CH3)(3-n) complex ions: Effect of the methyl substitution Guo WY, Liu HC, Yang SH
6071 - 6082	Excited states of beryllium atom from explicitly correlated wave functions Galvez FJ, Buendia E, Sarsa A
6083 - 6102	Accurate quantum calculations on three-body collisions in recombination and collision-induced dissociation. I. Converged probabilities for the H+Ne-2 system Parker GA, Walker RB, Kendrick BK, Pack RT
6103 - 6107	Should bromoform absorb at wavelengths longer than 300 nm? Peterson KA, Francisco JS
6108 - 6116	Ultrafast photodissociation of Br-2: Laser-generated high-harmonic soft x-ray probing of the transient photoelectron spectra and ionization cross sections Nugent-Glandorf L, Scheer M, Samuels DA, Bierbaum VM, Leone SR
6117 - 6120	(HeBr2B)-Br-79,v=8 <- X,v''=0 excitation spectrum: Ab initio prediction and spectroscopic manifestation of a linear isomer Buchachenko AA, Prosmiti R, Cunha C, Delgado-Barrio G, Villarreal P
6121 - 6132	Electron spin echo envelope modulation theory for high electron spin systems in weak crystal field Astashkin AV, Raitsimring AM
6133 - 6141	Effective pair potentials in charged molecular systems: Water mediated interactions Bagatella-Flores N, Gonzalez-Mozuelos P
6142 - 6147	Optimal pump-dump control and time-frequency resolved spectroscopy of ground-state wave-packet focusing Shen ZW, Engel V, Xu RX, Cheng JX, Yan YJ
6148 - 6156	Theoretical and experimental studies of CIDNP kinetics in recombination of radical pairs by the method of switched external magnetic field. III. Free radicals in homogeneous solution Fedin MV, Bagryanskaya EG, Purtov PA, Makarov TN, Paul H
6157 - 6168	Interfacial properties deduced from nucleation experiments: A Cahn-Hilliard analysis Granasy L, Pusztai T, James PF
6169 - 6175	Verification of the nucleation theorem for the internally constrained one-dimensional hard rod fluid Punnathanam S, Corti DS
6176 - 6185	H2O-D2O condensation in a supersonic nozzle Heath CH, Streletzky K, Wyslouzil BE, Wolk J, Strey R
6186 - 6195	Analytical investigations of an electron-water molecule pseudopotential. II. Development of a new pair potential and molecular dynamics simulations Turi L, Borgis D
6196 - 6199	Experimental determination of the site-site radial distribution functions of supercooled ultrapure bulk water Botti A, Bruni F, Isopo A, Ricci MA, Soper AK
6200 - 6213	Intraband relaxation and temperature dependence of the fluorescence decay time of one-dimensional Frenkel excitons: The Pauli master equation approach Bednarz M, Malyshev VA, Knoester J
6214 - 6220	General theory for pulse propagation in two-photon active media Baev A, Gel'mukhanov F, Macak P, Luo Y, Agren H
6221 - 6234	Vibrational spectroscopy of a harmonic oscillator system nonlinearly coupled to a heat bath Kato T, Tanimura Y
6235 - 6238	Eley-Rideal abstraction of carbon from graphite by hyperthermal N+ ions Deng ZW, Souda R
6239 - 6251	Reactive and inelastic scattering dynamics of hyperthermal oxygen atoms on a saturated hydrocarbon surface Zhang JM, Garton DJ, Minton TK
6252 - 6258	Secondary ions produced by 400 eV He+ ion impact on N-2 and O-2 thin films at 8 K Hiraoka K, Sato T, Watanabe M, Mori K, Kimura M
6259 - 6265	Adsorption behavior of Lander molecules on Cu(110) studied by scanning tunneling microscopy Schunack M, Rosei F, Naitoh Y, Jiang P, Gourdon A, Laegsgaard E, Stensgaard I, Joachim C, Besenbacher F
6266 - 6270	Ultrathin liquid films under alternating intermolecular potential fields and capillary force Suh KY, Lee HH
6271 - 6280	Grand canonical Monte Carlo simulation of hydration forces between nonorienting and orienting structureless walls Hayashi T, Pertsin AJ, Grunze M
6281 - 6288	Dielectric spectroscopy on the plastically crystalline phase of cyanocyclohexane Tschirwitz C, Benkhof S, Blochowicz T, Rossler E
6289 - 6299	Constrained dynamics in supramolecular structures of poly(p-phenylenes) with ethylene oxide side chains: A combined dielectric and nuclear magnetic resonance investigation Mierzwa M, Floudas G, Neidhofer M, Graf R, Spiess HW, Meyer WH, Wegner G
6300 - 6307	Comparison of topological properties between end-linked and statistically cross-linked polymer networks Michalke W, Lang M, Kreitmeier S, Goritz D
6308 - 6312	Penetrability in model colloid-polymer mixtures Schmidt M, Fuchs M
6313 - 6322	The global phase diagram of the Gay-Berne model de Miguel E, Vega C
6323 - 6330	Folding/unfolding kinetics on a semiflexible polymer chain Sakaue T, Yoshikawa K
6331 - 6335	Simulation of crystallization of entangled polymer chains Xu L, Fan ZY, Zhang HD, Bu HS
6336 - 6349	Shear viscosity of a supercooled polymer melt via nonequilibrium molecular dynamics simulations Varnik F, Binder K
6350 - 6359	Shear-induced structure in polymer blends with viscoelastic asymmetry Hobbie EK, Jeon HS, Wang H, Kim H, Stout DJ, Han CC
6360 - 6371	Critical lines and phase coexistence of polymer solutions: A quantitative comparison between Wertheim's thermodynamic perturbation theory and computer simulations MacDowell LG, Virnau P, Muller M, Binder K
6372 - 6377	Sample size autocorrelation analysis of kinetic data: Resolving reaction path heterogeneity Murugan R
6378 - 6379	Comment on "A reaction-path Hamiltonian described with quasirectilinear vibrational coordinates constructed from a nonlinear combination of curvilinear internal coordinates: Application to examination of the reaction CH4+F -> CH3+HF" [J. Chem. Phys. 113, 3136 (2000)] Natanson G
6380 - 6380	Molecular constants and Rydberg-Klein-Rees (RKR) potential curve for the Na-2 1 (3)Sigma(-)(g) state (vol 111, pg 3494, 1999) Liu YM, Li J, Chen DY, Li L, Jones KM, Ji B, Le Roy RJ