Journal of Chemical Physics

Journal of Chemical Physics, Vol.109, No.13 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (59 articles)

5171 - 5174	Spectroscopy and dynamics of the H-2-CN van der Waals complex Chen YL, Heaven MC
5175 - 5176	Transport coefficients of liquid transition metals: A computer simulation study using the embedded atom model Alemany MMG, Rey C, Gallego LJ
5177 - 5186	Resonance affected scattering: Comparison of two hybrid methods involving filter diagonalization and the Lanczos method McCormack DA, Kroes GJ, Neuhauser D
5187 - 5193	On mean residence and first passage times in finite one-dimensional systems Bar-Haim A, Klafter J
5194 - 5202	Coordinates scaling and multiple time step algorithms for simulation of solvated proteins in the NPT ensemble Marchi M, Procacci P
5203 - 5211	Atomic Fukui function indices and local softness ab initio Balawender R, Komorowski L
5212 - 5220	Coupling-constant dependence of the density functional correlation energy Joubert DP, Srivastava GP
5221 - 5230	Resonance emission spectroscopy of predissociating SO2 (C)over-tilde(1 B-1(2)): Coupling with a repulsive (1)A(1) state near 200 nm Ray PC, Arendt MF, Butler LJ
5231 - 5246	Dissociation dynamics of acetylene Rydberg states as a function of excited state lifetime Loffler P, Wrede E, Schnieder L, Halpern JB, Jackson WM, Welge KH
5247 - 5256	Zero electron kinetic energy spectroscopy of the KrBr-, XeBr-, and KrCl- anions Yourshaw I, Lenzer T, Reiser G, Neumark DM
5257 - 5263	Rate constants for the reaction of Ar+ with O-2 and CO as a function of temperature from 300 to 1400 K: Derivation of rotational and vibrational energy effects Midey AJ, Viggiano AA
5264 - 5268	The chemical bonding and electronic structure of RhC, RhN, and RhO by anion photoelectron spectroscopy Li X, Wang LS
5269 - 5275	Collision induced dissociation, proton abstraction, and charge transfer for low energy collisions involving CH4+ Peko BL, Dyakov IV, Champion RL
5276 - 5282	Rotational spectrum and structure of the OCS-(CO2)(2) trimer Peebles SA, Kuczkowski RL
5283 - 5289	A spectroscopic study of CaOCH3 using the pump/probe microwave and the molecular beam optical Stark techniques Namiki KC, Robinson JS, Steimle TC
5290 - 5299	An ab initio path integral molecular dynamics study of double proton transfer in the formic acid dimer Miura S, Tuckerman ME, Klein ML
5300 - 5307	Collision energy dependence and product recoil velocity analysis of O+(S-4)+C2H2 charge-transfer and chemical reaction channels Chiu YH, Dressler RA, Levandier DJ, Williams S, Murad E
5308 - 5318	Electronic excitation of gaseous pyrrole and pyrazole by inner-shell electron energy loss spectroscopy Duflot D, Hannay C, Flament JP, Hubin-Franskin MJ
5319 - 5326	A helium atom scattering study of the structure and dynamics of a Xe monolayer on NaCl(001) Gerlach R, Graham AP, Toennies JP, Weiss H
5327 - 5337	On the resonant coherent two-dimensional Raman scattering Cho MH
5338 - 5343	The dynamics of hydrogen abstraction reactions: Crossed-beam reaction Cl+n-C5H12 -> C5H11+HCl Hemmi N, Suits AG
5344 - 5350	Binding energies of palladium carbonyl cluster anions: Collision-induced dissociation of Pd-3(CO)(n)(-) (n=0-6) Spasov VA, Ervin KM
5351 - 5355	Submillimeter-wave spectrum of the AsH2 radical in the B-2(1) ground electronic state Fujiwara H, Kobayashi K, Ozeki H, Saito S
5356 - 5362	Accurate determination of molecular structures by x-ray absorption spectroscopy Filipponi A, D' Angelo PD
5363 - 5371	Dynamic isotope effect on the product energy partitioning in CH2OH+-> CHO++H-2 Rhee YM, Kim MS
5372 - 5382	UV photodissociation dynamics of allyl radical by photofragment translational spectroscopy Stranges D, Stemmler M, Yang XM, Chesko JD, Suits AG, Lee YT
5383 - 5392	Microwave spectra and structure of an isoxazole-CO van der Waals complex McGlone S, Bauder A
5393 - 5403	An ab initio derived torsional potential energy surface for the cyclic water tetramer Graf S, Leutwyler S
5404 - 5419	Four-dimensional model calculation of torsional levels of cyclic water tetramer Sabo D, Bacic Z, Graf S, Leutwyler S
5420 - 5432	Microwave spectra of the Ne-N-2 van der Waals complex: Experiment and theory Jager W, Xu Y, Armstrong G, Gerry MCL, Naumkin FY, Wang F, McCourt FRW
5433 - 5438	Rotational spectra of the carbon chain free radicals C10H, C12H, C13H, and C14H Gottlieb CA, McCarthy MC, Travers MJ, Grabow JU, Thaddeus P
5439 - 5445	The pure rotational spectrum of yttrium monobromide Walker KA, Gerry MCL
5446 - 5454	Product rotational polarization in the photoinitiated bimolecular reaction A+BC -> AB+C on attractive, mixed and repulsive surfaces Wang ML, Han KL, He GZ
5455 - 5465	Vibrational echo spectroscopy: Spectral selectivity from vibrational coherence Rector KD, Zimdars D, Fayer MD
5466 - 5468	Femtosecond relaxation of 2-amino-7-nitrofluorene in acetonitrile: Observation of the oscillatory contribution to the solvent response Ruthmann J, Kovalenko SA, Ernsting NP, Ouw D
5469 - 5480	High resolution Raman study of phonon and vibron bandwidths in isotopically pure and natural benzene crystal Pinan JP, Ouillon R, Ranson P, Becucci M, Califano S
5481 - 5486	The Kauzmann paradox interpreted via the theory of frustration-limited-domains Kivelson D, Tarjus G
5487 - 5492	Temperature dependent spectral densities and quantum activated rate theory Antoniou D, Schwartz SD
5493 - 5507	Longitudinal rotational resonance echoes in solid state nuclear magnetic resonance: Investigation of zero quantum spin dynamics Karlsson T, Levitt MH
5508 - 5510	Preliminary study on the charge transfer and bond ionicity of binary crystals Wu ZJ, Meng QB, Zhang SY
5511 - 5523	Vibrational relaxation of azide ion in water: The role of intramolecular charge fluctuation and solvent-induced vibrational coupling Morita A, Kato S
5524 - 5541	Coherence motion of photoinduced nonadiabatic charge transfer reaction in solution: A numerical study of pump-probe spectroscopy Sheu SY, Yang DY
5542 - 5546	Rotating-frame level matching study of CH3 tunneling in solid propionic acid Choi CH, Pintar MM
5547 - 5564	Potential models for simulations of the solvated proton in water Ojamae L, Shavitt I, Singer SJ
5565 - 5575	Theory of nonstationary activated rate processes: Nonexponential kinetics Chaudhuri JR, Gangopadhyay G, Ray DS
5576 - 5584	Nonlinear optical response of molecules in a nonequilibrium solvation model Sylvester-Hvid KO, Mikkelsen KV, Jonsson D, Norman P, Agren H
5585 - 5595	Adsorption of CO on Rh(100) studied by ab initio local-density functional calculations Eichler A, Hafner J
5596 - 5606	Analytical treatment of a simple fluid adsorbed in a slit-pore Schoen M, Diestler DJ
5607 - 5613	Adsorption mechanisms and surface heterogeneity in the oxidation reaction of CO Cortes J, Valencia E, Araya P
5614 - 5621	Structure formation during the crystallization induction period of a short chain-molecule system: A molecular dynamics study Takeuchi H
5622 - 5626	Simulation of polymers with rebound selection Alexandrowicz Z
5627 - 5638	Small-angle x-ray scattering analysis of polymer-protected platinum, rhodium, and platinum/rhodium colloidal dispersions Hashimoto T, Saijo K
5639 - 5650	A theory for compressible binary lattice polymers: Influence of chain conformational properties Wang SX, Nies E, Cifra P
5651 - 5658	A theoretical study of Gemini surfactant phase behavior Layn KM, Debenedetti PG, Prud'homme RK
5659 - 5669	Finite chain length effects on the coil-globule transition of stiff-chain macromolecules: A Monte Carlo simulation Ivanov VA, Paul W, Binder K
5670 - 5680	The second virial coefficient of hard alkane models MacDowell LG, Vega C
5681 - 5690	Vapor-liquid equilibria of linear and branched alkanes from perturbation theory MacDowell LG, Vega C
5691 - 5692	Comment on "Normal, single-file, and dual-mode diffusion of binary adsorbate mixtures in AlPO4-5" [J. Chem. Phys. 107, 4384 (1997)] Hahn K, Karger J
5693 - 5694	Response to "Comment on 'Normal, single-file, and dual-mode diffusion of binary adsorbate mixtures in AlPO4-5'" [J. Chem. Phys. 109, 5691 (1998)] Sholl DS, Fichthorn KA