Journal of Chemical Physics

Journal of Chemical Physics, Vol.115, No.16 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (53 articles)

7341 - 7343	Lifetime and decomposition pathways of a chemically bound helium compound Chaban GM, Lundell J, Gerber RB
7344 - 7347	A cluster model study of the electron-phonon interaction in magnesium diborate Yoshizawa K, Kondo M
7348 - 7355	Valence basis sets for relativistic energy-consistent small-core lanthanide pseudopotentials Cao XY, Dolg M
7356 - 7363	Direct perturbation theory of magnetic properties and relativistic corrections for the point nuclear and Gaussian nuclear models Hennum AC, Klopper W, Helgaker T
7364 - 7374	Four-wave mixing in two-level atoms with stochastically modulated transition frequencies Green JC, Kemple MD, Vemuri G
7375 - 7381	High order nonadiabatic perturbation theory on different adiabatic bases Dufey F
7382 - 7392	Local spin Clark AE, Davidson ER
7393 - 7400	Theoretical study of spin-orbit coupling constants for O-2(+) (A (2)Pi(3/2,1/2u), v(+)=0-17 and a (4)Pi(5/2,3/2,1/2,-1/2u), v(+)=0-25) Fedorov DG, Gordon MS, Song Y, Ng CY
7401 - 7412	The potential energy curve and dipole polarizability tensor of mercury dimer Schwerdtfeger P, Wesendrup R, Moyano GE, Sadlej AJ, Greif J, Hensel F
7413 - 7419	The 530 nm system of KRb observed in a pulsed molecular beam: New electric quadrupole transitions (1 (1)Delta-X (1)Sigma(+)) Lee Y, Yun C, Yoon Y, Kim T, Kim B
7420 - 7428	Temperature dependence of line mixing effects in the stimulated Raman Q-branch of CO in He: A further test of close coupling calculations Boissoles J, Thibault F, Domenech JL, Bermejo D, Boulet C, Hartmann JM
7429 - 7435	Ionization and dissociation mechanisms of ketene using resonance-enhanced multiphoton ionization mass spectrometer: (2+2) versus (2+1) schemes Lee WY, Lee WB, Fu H, Pan CC, Lin KC
7436 - 7441	Semiclassical modeling of infrared pressure-broadened linewidths: A comparative analysis in CO2-Ar at various temperatures Buldyreva J, Chrysos M
7442 - 7449	A comparative study of electron and positron scattering from molecules. IV. CH3Cl, CH3Br, and CH3I molecules Kimura M, Sueoka O, Makochekanwa C, Kawate H, Kawada M
7450 - 7459	Permanent and transition dipole moments in CaF and CaCl Raouafi S, Jeung GH, Jungen C
7460 - 7473	The energy distribution, angular distribution, and alignment of the O(D-1(2)) fragment from the photodissociation of ozone between 235 and 305 nm Dylewski SM, Geiser JD, Houston PL
7474 - 7484	Photodissociation dynamics of the CH2Cl radical: Ion imaging studies of the Cl+CH2 channel Dribinski V, Potter AB, Demyanenko AV, Reisler H
7485 - 7494	Electronic structure of halogen-substituted methyl radicals: Excited states of CH2Cl and CH2F Levchenko SV, Krylov AI
7495 - 7502	The potential energy surface of excited states by time-dependent density functional theory: The reaction of sulfur atom and nitrogen dioxide Chen WC, Yu CH
7503 - 7512	Theoretical study on the photoisomerization of azobenzene Ishikawa T, Noro T, Shoda T
7513 - 7521	Accurate ab initio spectroscopic and thermodynamic properties of BBrx and HBBrx (x=0,+1,-1) Peterson KA, Flowers BA, Francisco JS
7522 - 7533	Theoretical analysis of electronic absorption spectra of vitamin B-12 models Andruniow T, Kozlowski PM, Zgierski MZ
7534 - 7542	Vibrational spectroscopy of matrix-isolated, mass-selected cyanoacetylene cations Smith-Gicklhorn AM, Lorenz M, Kolos R, Bondybey VE
7543 - 7549	Dispersed fluorescence spectroscopy of jet-cooled AgAu and Pt-2 Fabbi JC, Langenberg JD, Costello QD, Morse MD, Karlsson L
7550 - 7553	Fast and accurate thermodynamics of square-well systems from umbrella-sampling simulations of hard-sphere systems Zhou YQ
7554 - 7563	A general approach to the electronic spin relaxation of Gd(III) complexes in solutions. Monte Carlo simulations beyond the Redfield limit Rast S, Fries PH, Belorizky E, Borel A, Helm L, Merbach AE
7564 - 7574	Equilibrium and nonequilibrium molecular-dynamics simulations of the central force model of water Bresme F
7575 - 7585	Sound absorption in nonelectrolyte aqueous solutions Endo H, Honda K
7586 - 7591	Scaling of local density correlations in a fluid close to freezing Saija F, Prestipino S, Giaquinta PV
7592 - 7598	A statistical mechanics/density functional approach to the thermodynamics of liquids Canepa C
7599 - 7608	Liquid-to-crystal nucleation: Automated lag-time apparatus to study supercooled liquids Heneghan AF, Wilson PW, Wang GM, Haymet ADJ
7609 - 7621	Ultrafast exciton dynamics of J-aggregates in room temperature solution studied by third-order nonlinear optical spectroscopy and numerical simulation based on exciton theory Ohta K, Yang M, Fleming GR
7622 - 7628	Quantum effects in liquid water: Path-integral simulations of a flexible and polarizable ab initio model Stern HA, Berne BJ
7629 - 7643	Unusual vibrational dynamics of the acetic acid dimer Lim M, Hochstrasser RM
7644 - 7649	Salt effects over the swelling of ionized mesoscopic gels Fernandez-Nieves A, Fernandez-Barbero A, de las Nieves FJ
7650 - 7656	High field electron paramagnetic resonance of Gd3+-doped glasses: Line shapes and average ion distances in silicates Smirnov AI, Sen S
7657 - 7668	Photodissociation of methyl nitrite on Ag(111): Simulation Kim SK, White JM, Agrawal PM, Thompson DL
7669 - 7677	Tetra point wetting of liquid K-KCl mixtures: Spectroscopic characterization of mesoscopic wetting and prewetting films Staroske S, Freyland W, Nattland D
7678 - 7684	Spatiotemporal reaction-diffusion patterns emerging on cylindrical surfaces due to global coupling Savin I, Nekhamkina O, Sheintuch M
7685 - 7696	Mechanisms of translational and rotational energy transfer in (N-2)(n) cluster-surface scattering Koch DM, Peslherbe GH, Vach H
7697 - 7704	Sphingomyelin at the air-water interface Vaknin D, Kelley MS, Ocko BM
7705 - 7712	Substrate effects on the fractal kinetics of a simple surface reaction Moiny F, Dumont M
7713 - 7724	Cu(001) to HD energy transfer and translational to rotational energy conversion on surface scattering Goncharova LV, Braun J, Ermakov AV, Bishop GG, Smilgies DM, Hinch BJ
7725 - 7735	The dynamics of vibrational excitations on surfaces: CO on Ru(001) Bonn M, Hess C, Wolf M
7737 - 7743	Time-resolved two-dimensional vibrational spectroscopy of a short alpha-helix in water Woutersen S, Hamm P
7744 - 7752	Density-functional theory of the crystallization of hard polymeric chains Sushko N, van der Schoot P, Michels MAJ
7753 - 7761	Proton friction and diffusion coefficients in hydrated polymer electrolyte membranes: Computations with a non-equilibrium statistical mechanical model Paddison SJ, Paul R, Zawodzinski TA
7762 - 7771	A statistical mechanical model for the calculation of the permittivity of water in hydrated polymer electrolyte membrane pores Paul R, Paddison SJ
7772 - 7782	Three-dimensional dynamic Monte Carlo simulations of driven polymer transport through a hole in a wall Chern SS, Cardenas AE, Coalson RD
7783 - 7792	The rheology and morphology of phase-separating fluids with viscosity contrast Zhang ZL, Zhang HD, Yang YL
7793 - 7794	On the isothermal-isobaric ensemble partition function Han KK, Son HS
7795 - 7795	Comment on "Mixture model description of the T-, P dependence of the refractive index of water" [J. Chem. Phys. 114, 3157 (2001)] Harvey AH
7796 - 7797	Response to "Comment on 'Mixture model description of the T-, P dependence of the refractive index of water' " [J. Chem. Phys. 115, 7795 (2001)] Cho CH, Urquidi J, Gellene GI