Journal of Chemical Physics

Journal of Chemical Physics, Vol.110, No.17 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (70 articles)

8217 - 8220	High resolution photoelectron spectroscopy of C-60(-) Wang XB, Ding CF, Wang LS
8221 - 8224	The translational energy of desorbing products in NO and N2O decomposition on Pd (110) Ohno Y, Kimura K, Bi M, Matsushima T
8225 - 8228	Double flip of orientation for a lamellar diblock copolymer under shear Leist H, Maring D, Thurn-Albrecht T, Wiesner U
8229 - 8232	State-specific excitation function for Cl(P-2)+H-2 (v = 0, j): Effects of spin-orbit and rotational states Lee SH, Lai LH, Liu KP, Chang H
8233 - 8235	Connected quadruples for the frequencies of O-3 Kucharski SA, Bartlett RJ
8236 - 8245	On non-negativity of Fukui function indices Roy RK, Pal S, Hirao K
8246 - 8253	Accurate computation of quantum densities of states and RRKM rate constants for large polyatomic molecules: The STAIR method Wadi H, Pollak E
8254 - 8282	Exact method for the simulation of Coulombic systems by spherically truncated, pairwise r(-1) summation Wolf D, Keblinski P, Phillpot SR, Eggebrecht J
8283 - 8294	Effective Hamiltonians for degenerate and quasidegenerate direct perturbation theory of relativistic effects Kutzelnigg W
8295 - 8302	Molecular dynamics simulations in the grand canonical ensemble: Formulation of a bias potential for umbrella sampling Shroll RM, Smith DE
8303 - 8308	A minimal subspace residual method for large-scale eigenvalue problems Huang YH, Hoffman DK, Kouri DJ
8309 - 8317	Quadrature integration for orthogonal wavelet systems Johnson BR, Modisette JP, Nordlander PJ, Kinsey JL
8318 - 8327	Gauge invariant coupled cluster response theory Pedersen TB, Koch H, Hattig C
8328 - 8337	Density-matrix-spectroscopic algorithm for excited-state adiabatic surfaces and molecular dynamics of a protonated Schiff base Tsiper EV, Chernyak V, Tretiak S, Mukamel S
8338 - 8347	Morphing ab initio potentials: A systematic study of Ne-HF Meuwly M, Hutson JM
8348 - 8360	Coupled cluster response theory for solvated molecules in equilibrium and nonequilibrium solvation Christiansen O, Mikkelsen KV
8361 - 8368	Oscillatory dynamics in low-dimensional supports: A lattice Lotka-Volterra model Provata A, Nicolis G, Baras F
8369 - 8383	The effect of laser bandwidth on the signal detected in two-color, resonant four-wave mixing spectroscopy Di Teodoro F, McCormack EF
8384 - 8396	Re-examination of atomization energies for the Gaussian-2 set of molecules Feller D, Peterson KA
8397 - 8407	Vibrational spectroscopy of 2-pyridone and its clusters in supersonic jets: Structures of the clusters as revealed by characteristic shifts of the NH and C=O bands Matsuda Y, Ebata T, Mikami N
8408 - 8416	Quantum calculations of highly excited vibrational spectrum of sulfur dioxide. I. Eigenenergies and assignments up to 15,000 cm(-1) Ma GB, Chen RQ, Guo H
8417 - 8423	Variational calculations of rovibrational energies of CH4 and isotopomers in full dimensionality using an ab initio potential Carter S, Shnider HM, Bowman JM
8424 - 8428	Perturbed hyperfine doubling in the A(2)Pi(1/2) and [18.6]0.5 states of YbF Sauer BE, Cahn SB, Kozlov MG, Redgrave GD, Hinds EA
8429 - 8435	Size selectivity by cation-pi interactions: Solvation of K+ and Na+ by benzene and water Cabarcos OM, Weinheimer CJ, Lisy JM
8436 - 8442	Formation of CF3O- in the gas phase Morris RA, Miller TM, Paulson JF, Viggiano AA, Feldmann MT, King RA, Schaefer HF
8443 - 8447	Potential curves for the ground states and some excited states of MgNe, Mg+Ne, and Mg+2Ne van der Waals complexes Leung AWK, Julian RR, Breckenridge WH
8448 - 8460	Photodissociation of HOBr. I. Ab initio potential energy surfaces for the three lowest electronic states and calculation of rotational-vibrational energy levels and wave functions Fusti-Molnar L, Szalay PG, Balint-Kurti GG
8461 - 8475	Six-dimensional calculation of intermolecular states in molecule large molecule complexes by filter diagonalization: Benzene-H2O Kim W, Neuhauser D, Wall MR, Felker PM
8476 - 8484	Resonance enhanced multiphoton ionization spectroscopy of jet cooled (CS2)-C-12-S-32 and (CSS)-C-12-S-34-S-32 from 45,500 to 48,000 cm(-1) Beatty AS, Shiell RC, Chang D, Hepburn JW
8485 - 8491	The electronic spectra of jet-cooled 5-phenyltropolone: Phenyl torsion and its effect on proton tunneling Tsuji T, Hayashi Y, Hamabe H, Kawakami H, Mori A, Nishimura Y, Sekiya H
8492 - 8500	Photodissociation dynamics of argon cluster ions Ikegami T, Iwata S
8501 - 8512	Fluorobenzene center dot center dot center dot water and difluorobenzene center dot center dot center dot water systems: An ab initio investigation Tarakeshwar P, Kim KS, Brutschy B
8513 - 8524	State-to-state rate coefficients for rotational relaxation of CO in Ar Belikov AE, Smith MA
8525 - 8532	Accurate intermolecular ground state potential of the Ar-N-2 complex Fernandez B, Koch H, Makarewicz J
8533 - 8542	Bound-free gas transport coefficients via the time correlation formulation based on an atomic picture Snider RF, Alavi S
8543 - 8554	Rotationally inelastic scattering of jet cooled H2O with Ar: State-to-state cross sections and rotational alignment effects Chapman WB, Kulcke A, Blackmon BW, Nesbitt DJ
8555 - 8563	Low temperature relaxation of OH in the X-2 Pi and A(2)Sigma states in an argon free-jet Ahern MM, Smith MA
8564 - 8576	Vibrationally mediated photolysis dynamics of H2O in the v(OH)=3 manifold: Far off resonance photodissociation cross sections and OH product state distributions Votava O, Plusquellic DF, Nesbitt DJ
8577 - 8588	A viscoelastic continuum model of nonpolar solvation. III. Electron solvation and nonlinear coupling effects Berg MA
8589 - 8596	Theory for determination of the low-frequency time-dependent response function in liquids using time-resolved terahertz pulse spectroscopy Kindt JT, Schmuttenmaer CA
8597 - 8604	The reaction ensemble method for the computer simulation of chemical and phase equilibria. II. The Br-2+Cl-2+BrCl system Lisal M, Nezbeda I, Smith WR
8605 - 8613	Mesoscopic model for solvent dynamics Malevanets A, Kapral R
8614 - 8621	Negative coupling during oscillatory pattern formation on a ring electrode Christoph J, Otterstedt RD, Eiswirth M, Jaeger NI, Hudson JL
8622 - 8627	Thermal diffusion in (LiCl,RH2O) Colombani J, Bert J, Dupuy-Philon J
8628 - 8635	A perturbative density functional theory of inhomogeneous fluid mixture Choudhury N, Ghosh SK
8636 - 8642	Photolysis at 266 nm of argon matrix isolated ozone monomer Bahou M, Schriver-Mazzuoli L, Schriver A
8643 - 8652	Time dependent diffusion coefficient and the transient dynamics of diffusion controlled bimolecular reactions in liquids: A mode coupling theory analysis Morita A, Bagchi B
8653 - 8662	Diffusive and oscillatory dynamics of liquid iodobenzene measured by femtosecond optical Kerr effect Bartolini P, Ricci M, Torre R, Righini R, Santa I
8663 - 8675	Viscous fingering in reaction-diffusion systems De Wit A, Homsy GM
8676 - 8678	Is there a crystallization pendulum? Avramov I, Hoche T, Russel C
8679 - 8686	Hydrothermodynamic consideration on the steady-state motion of a solid/liquid interface Mori A
8687 - 8695	Ultrafast relaxation processes of excitons to the relaxed excited state in one-dimensional dimethylglyoxime platinum complexes driven by intramolecular vibration Iwai S, Kamata T, Murata S, Fukaya T, Kodaira T, Mizukami F, Tachiya M, Yamamoto K, Ohta T
8696 - 8702	Quantum effects in the dissociative adsorption of hydrogen Gross A
8703 - 8713	High-resolution x-ray photoelectron spectroscopy study of the ethanol oxidation reaction on Pd(110) Holroyd RP, Bennett RA, Jones IZ, Bowker M
8714 - 8721	Mean field lattice model for adsorption isotherms in zeolite NaA Ayappa KG, Kamala CR, Abinandanan TA
8722 - 8729	Properties of a liquid-gas interface at high-rate evaporation Anisimov SI, Dunikov DO, Zhakhovskii VV, Malyshenko SP
8730 - 8741	Extent of reaction in energetic particulate mixtures: Role of composition and particle size ratio Ettelaie R, Buscall R, Frith WJ, Sutton D
8742 - 8747	Diffusion in random pores Lee JC
8748 - 8753	Simulation of surface restructuring and oscillations in CO-NO reaction on Pt(100) Zhdanov VP
8754 - 8766	Thermionic electron emission of small tungsten cluster anions on the milliseconds time scale Weidele H, Kreisle D, Recknagel E, Becker S, Kluge HJ, Lindinger M, Schweikhard L, Walther C, Ziegler J
8767 - 8785	Energy and momentum transfer of He atoms scattered from a lithium fluoride crystal surface Legge H, Manson JR, Toennies JP
8786 - 8791	Hydrogen-hydrogen intermolecular structure of polyethylene in the melt Londono JD, Annis BK, Habenschuss A, Smith GD, Borodin O, Tso C, Hsieh ET, Soper AK
8792 - 8801	Improved treatment of the lateral-reptative mixing and approximate analytical expressions for the lateral motion model of polymer melts Herman MF, Panajotova BV
8802 - 8818	Influence of cholesterol on dynamics of dimyristoylphosphatidylcholine bilayers as studied by deuterium NMR relaxation Trouard TP, Nevzorov AA, Alam TM, Job C, Zajicek J, Brown MF
8819 - 8824	Ab initio study of structural and cohesive properties of polymers: Polyiminoborane and polyaminoborane Abdurahman A, Albrecht M, Shukla A, Dolg M
8825 - 8834	Avoidance model for soft particles. I. Charged spheres and rods beyond the dilute limit Kramer EM, Herzfeld J
8835 - 8841	Formation of segmental clusters during relaxation of a fully extended polyethylene chain at 300 K: A molecular dynamics simulation Liao Q, Jin XG
8842 - 8843	Homogeneous nucleation of argon in an unsteady hypersonic flow field Zahoransky RA, Hoschele J, Steinwandel J
8844 - 8844	Ab initio study of the electronic spectrum of C2H2+: Investigation of structure and spectra involving low-lying doublet electronic states (vol 109, pg 3086, 1998) Peric M, Ostojic B, Engels B
8845 - 8845	Interactions, dynamics, and elasticity in charge-stabilized colloidal crystals (vol 109, pg 8659, 1998) Dufresne ER, Grier DG