Journal of Chemical Physics

Journal of Chemical Physics, Vol.112, No.22 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (43 articles)

9691 - 9694	Modeling ion-ion interaction in proteins: A molecular dynamics free energy calculation of the guanidinium-acetate association Rozanska X, Chipot C
9695 - 9698	Molecular dynamics simulations of shocked benzene Bickham SR, Kress JD, Collins LA
9699 - 9702	Quantum Monte Carlo: Direct calculation of corrections to trial wave functions and their energies Anderson JB
9703 - 9710	Quantum tunneling dynamics using hydrodynamic trajectories Bittner ER
9711 - 9715	Moller-Plesset convergence issues in computational quantum chemistry Stillinger FH
9716 - 9726	Continuous surface switching: An improved time-dependent self-consistent-field method for nonadiabatic dynamics Volobuev YL, Hack MD, Topaler MS, Truhlar DG
9727 - 9735	The fluctuation theorem and Green-Kubo relations Searles DJ, Evans DJ
9736 - 9748	Divergence in Moller-Plesset theory: A simple explanation based on a two-state model Olsen J, Jorgensen P, Helgaker T, Christiansen O
9749 - 9758	Collisional effects on angular momentum orientation in acetylene (X)over-tilde (1)Sigma(+)(g) (nu ''(2)=1,j ''). II. Disorientation by rotationally elastic and multiple inelastic collisions Rudert AD, Martin J, Gao WB, Zacharias H, Halpern JB
9759 - 9772	Structures, energies, vibrational spectra, and electronic properties of water monomer to decamer Lee HM, Suh SB, Lee JY, Tarakeshwar P, Kim KS
9773 - 9776	Electric field effects on the helium dimer Bruch LW
9777 - 9779	The (3)Sigma(-)(u)<- X (3)Sigma(-)(g) electronic spectrum of linear C-4 in the gas phase Linnartz H, Vaizert O, Motylewski T, Maier JP
9780 - 9782	Spectroscopy of mass-selected gadolinium dimers in argon matrices Chen XY, Fang L, Shen XL, Lombardi JR
9783 - 9790	Photoionization dynamics probed by angle-resolved photoelectron spectroscopy of NH3((B)over-tilde(1)E('')) Townsend D, Reid KL
9791 - 9801	Fourier transform spectroscopy and cross section measurements of the Herzberg III bands of O-2 at 295 K Yoshino K, Esmond JR, Parkinson WH, Thorne AP, Learner RCM, Cox G, Cheung ASC
9802 - 9809	Quantum mechanical integral cross sections and rate constants for the F+HD reactions Zhang DH, Lee SY, Baer M
9810 - 9821	Dielectric properties of glucose and maltose solutions Hochtl P, Boresch S, Steinhauser O
9822 - 9827	Excitation energy transfer of a bichromophoric cross-shaped molecule investigated by polarized fluorescence spectroscopy Schartel B, Kruger S, Wachtendorf V, Hennecke M
9828 - 9833	Structure formation in dipolar fluids driven by rotating fields Murashov VV, Patey GN
9834 - 9840	Crossover to potential energy landscape dominated dynamics in a model glass-forming liquid Schroder TB, Sastry S, Dyre JC, Glotzer SC
9841 - 9848	Two-dimensional hard dumbbells. I. Fluctuating cell model Gay SC, Rainwater JC, Beale PD
9849 - 9859	Two-dimensional hard dumbbells. II. Pressure in terms of free volumes and surfaces Gay SC, Rainwater JC, Beale PD
9860 - 9873	Light scattering study of the liquid-glass transition of meta-toluidine Aouadi A, Dreyfus C, Massot M, Pick RM, Berger T, Steffen W, Patkowski A, Alba-Simionesco C
9874 - 9880	A Monte Carlo-quantum mechanics study of the solvatochromic shifts of the lowest transition of benzene Coutinho K, Canuto S, Zerner MC
9881 - 9887	Combination of small angle scattering and three-dimensional stochastic reconstruction for the study of adsorption-desorption processes in Vycor porous glass Kikkinides ES, Kainourgiakis ME, Stefanopoulos KL, Mitropoulos AC, Stubos AK, Kanellopoulos NK
9888 - 9897	Desorption of CO from Ru(001) induced by near-infrared femtosecond laser pulses Funk S, Bonn M, Denzler DN, Hess C, Wolf M, Ertl G
9898 - 9908	Adsorption of acetone molecules on proton ordered ice. A molecular dynamics study Picaud S, Hoang PNM
9909 - 9916	Solid-liquid phase transition of Lennard-Jones fluid in slit pores under tensile condition Miyahara M, Kanda H, Shibao M, Higashitani K
9917 - 9928	1,2-propanediol and 1,3-propanediol homogeneous nucleation rates and phase transitions in the new phase critical embryos Anisimov MP, Koropchak JA, Nasibulin AG, Timoshina LV
9929 - 9939	Chemistry of NO2 on CeO2 and MgO: Experimental and theoretical studies on the formation of NO3 Rodriguez JA, Jirsak T, Sambasivan S, Fischer D, Maiti A
9940 - 9948	Inelastic collision processes of CH4 and C2H6 molecules at highly corrugated surfaces studied by the molecular beam scattering technique Kondo T, Tomii T, Hiraoka T, Ikeuchi T, Yagyu S, Yamamoto S
9949 - 9955	Heterogeneous nucleation or homogeneous nucleation? Liu XY
9956 - 9960	Tortuosity factor for permeant flow through a fractal solid Garza-Lopez RA, Naya L, Kozak JJ
9961 - 9966	Energy-dependent deposition processes of size-selected Ag nanoclusters on highly-oriented pyrolytic graphite Yamaguchi W, Yoshimura K, Tai Y, Maruyama Y, Igarashi K, Tanemura S, Murakami J
9967 - 9977	Condensation of supersaturated water vapor on submicrometer particles of SiO2 and TiO2 Chen CC, Tao CJ
9978 - 9985	Two-dimensional vibrational spectroscopy. V. Novel 2-dimensional surface vibrational spectroscopies of adsorbed molecules on surfaces or at interfaces Cho MH
9986 - 9995	Theoretical investigation of water formation on Rh and Pt surfaces Wilke S, Natoli V, Cohen MH
9996 - 10010	Symmetric diblock copolymer thin films confined between homogeneous and patterned surfaces: Simulations and theory Wang Q, Nath SK, Graham MD, Nealey PF, de Pablo JJ
10011 - 10016	Interfacial profiles of mismatched lamellae in thin diblock copolymer films Pereira GG, Williams DRM, Chakrabarti A
10017 - 10033	Theoretical study of collective modes in DNA at ambient temperature Cocco S, Monasson R
10034 - 10041	Phase behavior of two-dimensional hard rod fluids Bates MA, Frenkel D
10042 - 10048	Conserved linking in single- and double-stranded polymers Plewa JS, Witten TA
10049 - 10055	Rotational isomeric state chains on a high coordination lattice: Dynamic Monte Carlo algorithm details Clancy TC, Mattice WL