Journal of Chemical Physics

Journal of Chemical Physics, Vol.107, No.8 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (68 articles)

2705 - 2719	HO2 rovibrational eigenvalue studies for nonzero angular momentum Wu XDT, Hayes EF
2720 - 2727	Laser spectroscopy of the (A)over-tilde(2)Pi<-(X)over-tilde(2)Sigma(+) transition of ytterbium monoacetylide Loock HP, Berces A, Simard B, Linton C
2728 - 2733	Pulsed discharge nozzle Fourier transform microwave spectroscopy of the propargyl radical (H2CCCH) Tanaka K, Sumiyoshi Y, Ohshima Y, Endo Y, Kawaguchi K
2734 - 2737	On the molecular phase in coherent control Lee S
2738 - 2751	Spectroscopy and dynamics of rare gas-spherical top complexes .3. The infrared spectrum of the nu(3) band of Ne-SiH4 (j=1<-1 and j=2<-1 transitions) Brookes MD, Hughes DJ, Howard BJ
2752 - 2759	Line strengths of diatomics: The b(1)Sigma(+)v'=0->X-3 Sigma-v''=0 transition of the NF radical DiStefano G, Lenzi M, Piciacchia G, Ricci A
2760 - 2774	Theory and simulation of vibrational effects on structural measurements by solid-state nuclear magnetic resonance Ishii Y, Terao T, Hayashi S
2775 - 2781	Nuclear spin relaxation of spin one-half nuclei in the presence of neighboring higher-spin nuclei Werbelow LG, Kowalewski J
2782 - 2792	Rotationally resolved multiphoton ionization photoelectron spectroscopy of the [a(1)Delta]3d pi(2)Phi and [a(1)Delta]5p pi(2)Phi Rydberg states of the SH radical Milan JB, Buma WJ, deLange CA, Wang KH, McKoy V
2793 - 2797	Doped ionic magnetic fluids: A resonance characterization DaSilva GJ, Morais PC, Tourinho FA
2798 - 2806	Reactions of laser-ablated chromium atoms with dioxygen. Infrared spectra of CrO, OCrO, CrOO, CrO3, Cr(OO)(2), Cr2O2, Cr2O3 and Cr2O4 in solid argon Chertihin GV, Bare WD, Andrews L
2807 - 2812	Structural investigation of copper(II) chloride solutions using x-ray absorption spectroscopy DAngelo P, Bottari E, Festa MR, Nolting HF, Pavel NV
2813 - 2818	Explicit expressions for triatomic Eckart frames in Jacobi, Radau, and bond coordinates Wei H, Carrington T
2819 - 2828	Energy transfer investigations on pure Cr(III)-complex compounds using resonant emission measurements Nierhauve G, Schmidtke HH
2829 - 2838	Near-infrared band of the nitrate radical NO3 observed by diode laser spectroscopy Hirota E, Ishiwata T, Kawaguchi K, Fujitake M, Ohashi N, Tanaka I
2839 - 2844	Capture of lithium by He-4 clusters: Surface adsorption, penning ionization, and formation of HeLi+ Scheidemann AA, Kresin VV, Hess H
2845 - 2852	Determination of rate constants for butene isomerization by a temporal inversion method Li GY, Rabitz H
2853 - 2858	Initial conditions and paths in semiclassical tunneling Guo Y, Li SM, Thompson DL
2859 - 2871	A multidimensional Landau-Zener description of chemical reaction dynamics and vibrational coherence Zhu LY, Widom A, Champion PM
2872 - 2880	Interplay of geminate and bimolecular reactions in multistage electron and energy transfer Burshtein AI, Frantsuzov PA
2881 - 2889	Slow manifold structure and the emergence of mixed-mode oscillations Goryachev A, Strizhak P, Kapral R
2890 - 2902	Collisional energy transfer of highly vibrationally excited NO2: The role of intramolecular vibronic coupling and the transition dipole coupling mechanism Hartland GV, Qin D, Dai HL, Chen C
2903 - 2912	Stochastic theories of the activated complex and the activated collision: The RNA example Jacob C, Breton N, Daegelen P
2913 - 2919	Probability distribution of the chemical states of a closed system and thermodynamic law of mass action from kinetics: The RNA example Jacob C, Breton N, Daegelen P, Peccoud J
2920 - 2929	Resonance Raman study of solvent dynamics in electron transfer .2. Betaine-30 in CH3OH and CD3OD Zong YP, McHale JL
2930 - 2941	Bound states and time-dependent dynamics of the N2H+ molecular ion in its ground electronic state .1. 2D treatment Mahapatra S, Vetter R, Zuhrt C, Nguyen HT, Ritschel T, Zulicke L
2942 - 2949	The structure of supercritical heavy water as studied by neutron diffraction BellissentFunel MC, Tassaing T, Zhao H, Beysens D, Guillot B, Guissani Y
2950 - 2961	Superexcited states of OCS probed by using photoelectron spectroscopy for autoionizing atomic sulfur Hikosaka Y, Hattori H, Hikida T, Mitsuke K
2962 - 2967	Negative ion photoelectron spectroscopy of the ground state, dipole-bound dimeric anion, (HF)(2)(-) Hendricks JH, deClercq HL, Lyapustina SA, Bowen KH
2968 - 2973	Theoretical study of the dipole-bound anion (HF)(2)(-) Gutowski M, Skurski P
2974 - 2989	Semiclassical wave packet calculations on ion-molecule reactions: Studies on B+(P-3(u))+H-2 reaction Vijay A, Billing GD
2990 - 2999	A study of aqueous glutamic acid using the effective fragment potential method Day PN, Pachter R
3000 - 3006	Chemical potential, hardness, hardness and softness kernel and local hardness in the isomorphic ensemble of density functional theory DeProft F, Liu SB, Parr RG
3007 - 3013	Accuracy of electronic wave functions in quantum Monte Carlo: The effect of high-order correlations Huang CJ, Umrigar CJ, Nightingale MP
3014 - 3020	Use of Gauss-Hermite quadrature in the treatment of predissociation resonances with the complex-scaling method Li Y, Bludsky O, Hirsch G, Buenker RJ
3021 - 3031	Combined ab initio and density functional study on polaron to bipolaron transitions in oligophenyls and oligothiophenes Irle S, Lischka H
3032 - 3041	A new integral equation formalism for the polarizable continuum model: Theoretical background and applications to isotropic and anisotropic dielectrics Cances E, Mennucci B, Tomasi J
3042 - 3055	Is the Gaussian-2 technique reliable for determining the energetics of small molecular dications? Petrie S
3056 - 3070	Geometric and electronic structures of silicon-sodium binary clusters .1. Ionization energy of SinNam Kishi R, Iwata S, Nakajima A, Kaya K
3071 - 3079	Noble gas temperature control of metal clusters: A molecular dynamics study Westergren J, Gronbeck H, Kim SG, Tomanek D
3080 - 3084	Structure of liquid carbon tetrachloride up to the subcritical point measured by wide Q-range neutron diffraction Akatsuka H, Misawa M, Fukunaga T, Mizutani U, Furusaka M
3085 - 3097	Crossover Leung-Griffiths model and the phase behavior of dilute aqueous ionic solutions Belyakov MY, Kiselev SB, Rainwater JC
3098 - 3120	The short-time intramolecular dynamics of solutes in liquids .2. Vibrational population relaxation Goodyear G, Stratt RM
3121 - 3134	On the excess enthalpy and volume of two-component Lennard-Jones fluids in supercritical region: Is the mixture of simple liquids simple? Fujihara I, Nakanishi K
3135 - 3143	The frequency-dependent conductivity of a saturated solution of ZnBr2 in water: A molecular dynamics simulation Loffler G, Schreiber H, Steinhauser O
3144 - 3158	Shear flow simulations of biaxial nematic liquid crystals Sarman S
3159 - 3178	Variational energy band theory for polarons: Mapping polaron structure with the Toyozawa method Zhao Y, Brown DW, Lindenberg K
3179 - 3195	Variational energy band theory for polarons: Mapping polaron structure with the global-local method Brown DW, Lindenberg K, Zhao Y
3196 - 3203	Kinetic effect of cluster-cluster processes on homogeneous nucleation rates in one- and two-component systems Arstila H
3204 - 3209	A phase-space study of Bloch-Redfield theory Cao JS
3210 - 3221	A new definition of cavities for the computation of solvation free energies by the polarizable continuum model Barone V, Cossi M, Tomasi J
3222 - 3229	Waterlike anomalies from repulsive interactions Speedy RJ
3230 - 3238	A grand canonical simulation technique for dense and confined fluids with application to a Lennard-Jones fluid Attard P
3239 - 3246	Distributed approximating functional approach to the Fokker-Planck equation: Time propagation Wei GW, Zhang DS, Kouri DJ, Hoffman DK
3247 - 3252	Perturbation theory in the kinetics of first-order phase transitions Kukushkin SA, Osipov AV
3253 - 3261	On the molecular basis of hydrophobicity: A Monte Carlo study of propionic acid hydration SanRomanZimbron ML, OrtegaBlake I
3262 - 3266	Aspects of sorption and phase behavior of near-critical fluids confined to mesoporous media Schoen M, Thommes M, Findenegg GH
3267 - 3276	On lyotropic behavior of molecular bottle-brushes: A Monte Carlo computer simulation study Saariaho M, Ikkala O, Szleifer I, Erukhimovich I, tenBrinke G
3277 - 3288	Confined thin films of linear and branched alkanes Dijkstra M
3289 - 3294	Brownian dynamics simulation of diffusion-limited polymerization of rodlike molecules: Isotropic translational diffusion Gupta JS, Khakhar DV
3295 - 3299	An embedded cluster study of dimer buckling on the Si(100) surface Yang C, Lee SY, Kang HC
3300 - 3308	Dynamic simulation of a platelike particle dispersed system Yamamoto S, Matsuoka T
3309 - 3323	Six-dimensional quantum dynamics of dissociative chemisorption of H-2 on Cu(100) Kroes GJ, Baerends EJ, Mowrey RC
3324 - 3328	Three component spin echo generation by radiation damping Augustine MP, Hahn EL
3329 - 3332	Kinetics and dynamics in the photodissociation of the allyl radical Deyerl HJ, Gilbert T, Fischer I, Chen P
3333 - 3336	A fluid in contact with a semipermeable surface: Second-order integral equation approach Bryk P, Henderson D, Sokolowski S
3337 - 3338	Photodissociation of Cl2O at 248 and 308 nm Moore TA, Okumura M, Minton TK
3339 - 3340	Exact quantum stereodynamics: The steric effect for the Li+HF->LiF+H reaction Alvarino JM, Aquilanti V, Cavalli S, Crocchianti S, Lagana A, Martinez T