Journal of Chemical Physics

Journal of Chemical Physics, Vol.116, No.6 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (45 articles)

2335 - 2337	An accurate MGGA-based hybrid exchange-correlation functional Tao JM
2338 - 2341	Fractional dynamics approach to diffusion-assisted reactions in disordered media Sung JY, Barkai E, Silbey RJ, Lee S
2342 - 2345	New mechanism of membrane fusion Muller M, Katsov K, Schick M
2346 - 2353	Surface-hopping dynamics of a spin-boson system Mac Kernan D, Ciccotti G, Kapral R
2354 - 2360	Efficient time-independent wave packet scattering calculations within a Lanczos subspace: H+O-2 (J=0) state-to-state reaction probabilities Zhang H, Smith SC
2361 - 2369	Use of thermodynamic integration to calculate the hydration free energies of n-alkanes Wescott JT, Fisher LR, Hanna S
2370 - 2378	Bend-stretch Fermi resonance in DCO+ Robinson JD, Foltynowicz RJ, Prentice K, Bell P, Grant ER
2379 - 2387	Microwave rotational spectra of the Ar-3-NH3 van der Waals tetramer van Wijngaarden J, Jager W
2388 - 2394	Quantum dynamics of the D-2+OH reaction Zhang DH, Yang MH, Lee SY
2395 - 2399	The intermolecular potential energy surface of the He center dot NO+ cationic complex Soldan P, Lee EPF, Wright TG
2400 - 2406	Infrared resonance-enhanced multiphoton ionization spectroscopy of magnesium oxide clusters van Heijnsbergen D, von Helden G, Meijer G, Duncan MA
2407 - 2416	The molecular properties of chlorosyl fluoride, FClO, as determined from the ground-state rotational spectrum Muller HSP, Cohen EA
2417 - 2424	Hydrogen bonding and protonation in acid-base complexes: Methanesulfonic acid-pyridine Lehtonen O, Hartikainen J, Rissanen K, Ikkala O, Pietila LO
2425 - 2432	Electronic excitation spectra of Cl2O, ClOOCl, and F2O: A SAC-Cl study Tomasello P, Ehara M, Nakatsuji H
2433 - 2438	Control of molecular handedness using pump-dump laser pulses Hoki K, Gonzalez L, Fujimura Y
2439 - 2446	Nonadiabatic quantum reactive scattering calculations for the O(D-1)+H-2, D-2, and HD reactions on the lowest three potential energy surfaces Takayanagi T
2447 - 2455	Quantum beats in the S-1 dynamics of glyoxal Chang CS, Chen IC
2456 - 2463	Isotope effects in the electron impact ionization of H-2/D-2, H2O/D2O, and C6H6/C6D6 near threshold Hanel G, Gstir B, Fiegele T, Hagelberg F, Becker K, Scheier P, Snegursky A, Mark TD
2464 - 2471	Residual dipolar coupling in the CP/MAS nuclear magnetic resonance spectra of spin-1/2 nuclei coupled to quadrupolar nuclei application of floquet theory Kampermann H, Bain AD, Dumont RS
2472 - 2479	Viscosity dependence of geminate recombination efficiency after bimolecular charge separation Neufeld AA, Burshtein AI, Angulo G, Grampp G
2480 - 2486	Enthalpy and entropy contributions to the pressure dependence of hydrophobic interactions Ghosh T, Garcia AE, Garde S
2487 - 2492	Solving integral equations for binary and ternary systems Lotfollahi MN, Modarress H
2493 - 2501	Optimization of data acquisition and processing in Carr-Purcell-Meiboom-Gill multiple quantum magic angle spinning nuclear magnetic resonance Lefort R, Wiench JW, Pruski M, Amoureux JP
2502 - 2507	Translational diffusion and reorientational relaxation of water analyzed by site-site generalized Langevin theory Yamaguchi T, Chong SH, Hirata F
2508 - 2515	HKrF in solid krypton Pettersson M, Khriachtchev L, Lignell A, Rasanen M, Bihary Z, Gerber RB
2516 - 2528	Qualitative dynamics of generalized Langevin equations and the theory of chemical reaction rates Martens CC
2529 - 2535	Transport coefficients at metastable densities from models of generalized hydrodynamics Srivastava S, Das SP
2536 - 2541	Electronic energy dissipation in chloro-aluminum phthalocyanine/methanol system following nonlinear interaction with a train of picosecond pulses Wei TH, Huang TH, Hu JK
2542 - 2555	Vibronic effects on solvent dependent linear and nonlinear optical properties of push-pull chromophores: Julolidinemalononitrile Moran AM, Egolf DS, Blanchard-Desce M, Kelley AM
2556 - 2564	Formation of nanoclusters under radiation pressure in solution: A Brownian dynamics simulation study Jose PP, Bagchi B
2565 - 2571	Observations on an equation of state for water confined in narrow slit-pores Giaya A, Thompson RW
2572 - 2585	Simulation of proton transfer along ammonia wires: An "ab initio" and semiempirical density functional comparison of potentials and classical molecular dynamics Meuwly M, Karplus M
2586 - 2591	Transition events in butane simulations: Similarities across models Zuckerman DM, Woolf TB
2592 - 2598	Transient absorption of vibrationally excited water Bakker HJ, Nienhuys HK, Gallot G, Lascoux N, Gale GM, Leicknam JC, Bratos S
2599 - 2608	Kinetic model for Eley-Rideal and hot atom reactions between H atoms on metal surfaces Jackson B, Sha XW, Guvenc ZB
2609 - 2617	Selenium dimers and linear chains in one-dimensional cancrinite nanochannels: Structure, dynamics, and optical properties Poborchii VV, Lindner GG, Sato M
2618 - 2627	Evaluation of the small-angle x-ray scattering of carbons using parametrization methods Smarsly B, Antonietti M, Wolff T
2628 - 2635	Hydrogen defects in Forsterite: A test case for the embedded cluster method Braithwaite JS, Sushko PV, Wright K, Catlow CRA
2636 - 2641	Multifractal spectra and the relaxation of model polymer networks Blumen A, Jurjiu A
2642 - 2649	Collapse of Lennard-Jones homopolymers: Size effects and energy landscapes Calvo F, Doye JPK, Wales DJ
2650 - 2657	Thermodynamics and phase separation of a de-ionized colloidal system in the symmetric Poisson-Boltzmann and mean spherical approximation theories Bhuiyan LB, Outhwaite CW
2658 - 2662	Concentrated colloidal dispersions: On the relation of rheology with small angle x-ray and neutron scattering Versmold H, Musa S, Bierbaum A
2663 - 2664	Molecular dynamics simulations of water wires in a lipid bilayer and water/octane model systems Venable RM, Pastor RW
2665 - 2667	Comment on "Anti-cooperativity in hydrophobic interactions: A simulation study of spatial dependence of three-body effects and beyond" [J. Chem. Phys. 115, 1414 (2001)] Czaplewski C, Rodziewicz-Motowidlo S, Liwo A, Ripoll DR, Wawak RJ, Scheraga HA
2668 - 2669	Reply to "Comment on'Anti-cooperativity in hydrophobic interactions: A simulation study of spatial dependence of three-body effects and beyond'" [J. Chem. Phys. 116, 2665 (2002)] Shimizu S, Chan HS