Journal of Chemical Physics

Journal of Chemical Physics, Vol.107, No.23 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (74 articles)

9715 - 9725	Electronic spectroscopy and molecular structure of jet-cooled diphenylamine and diphenylamine derivatives Tretiakov IV, Cable JR
9726 - 9740	Polarization selectivity of nonresonant spectroscopies in isotropic media Murry RL, Fourkas JT
9741 - 9748	Temperature dependence of vibrational lifetimes at the critical density in supercritical mixtures Myers DJ, Urdahl RS, Cherayil BJ, Fayer MD
9749 - 9754	Femtosecond time-resolved two-photon ionization spectroscopy of K-2 Schwoerer H, Pausch R, Heid M, Engel V, Kiefer W
9755 - 9758	Rotational analysis of the B(2)A''-X(2)A'' origin band of the CH2CFO radical Wright SA, Dagdigian PJ
9759 - 9763	A structural model for associated liquid ethanol developed from transient spectroscopy Laenen R, Rauscher C
9764 - 9771	Raman spectroscopy of the N-C-O symmetric (nu(3)) and antisymmetric (nu(2)) stretch fundamentals in HNCO Brown SS, Berghout HL, Crim FF
9772 - 9782	Optical spectroscopy of jet-cooled FeC between 12,000 and 18,100 cm(-1) Brugh DJ, Morse MD
9783 - 9793	Role of guest-host intermolecular forces in photoinduced reorientation dyed liquid crystals Marrucci L, Paparo D, Maddalena P, Massera E, Prudnikova E, Santamato E
9794 - 9800	Electronically excited states in size selected solvated alkali metal atoms .2. Isotope effects in the spectroscopy of sodium water and sodium ammonia complexes Schulz CP, Nitsch C
9801 - 9806	Influence of exciton-exciton interaction on one-to-two exciton transitions in molecular aggregates with linear and circular geometries Juzeliunas G, Reineker P
9807 - 9817	The picosecond timescale relaxation of photoexcited quaterphenyl solution Matousek P, Parker AW, Towrie M, Toner WT
9818 - 9834	Highly excited vibrational states of HCP and their analysis in terms of periodic orbits: The genesis of saddle-node states and their spectroscopic signature Beck C, Keller HM, Grebenschikov SY, Schinke R, Farantos SC, Yamashita K, Morokuma K
9835 - 9841	Investigation of the pure rotational spectrum of magnesium monobromide by Fourier transform microwave spectroscopy Walker KA, Gerry MCL
9842 - 9851	Photodissociation of C2H at 193 nm: Branching ratios for the formation of C-2 in the X-1 Sigma(+)(g), A(1)Pi(u), and B'(1)Sigma(+)(g) states Sorkhabi O, Blunt VM, Lin H, Xu DD, Wrobel J, Price R, Jackson WM
9852 - 9856	Evidence of rotational autoionization in the threshold region of the photoionization spectrum of CH3 Litorja M, Ruscic B
9857 - 9863	Influence of chaos on the ionization induced fragmentation dynamics of van der Waals clusters Garcia ME, Reichardt D, Bennemann KH
9864 - 9877	Effects of a quantum-mechanically driven two-state gating mode on the diffusion-influenced bimolecular reactions Jung YJ, Hyeon C, Shin S, Lee S
9878 - 9889	Controlling nonpolar solvation time scales: An instantaneous normal mode viewpoint Kalbfleisch TS, Ziegler LD
9890 - 9893	Long-time tail effect of the velocity correlation on diffusion-controlled reactions Dong W
9894 - 9898	Theoretical study of the Coulombic explosion in doubly charged Xe clusters Athanasopoulos DC, Schmidt KE
9899 - 9906	Rotational energy analysis for rotating-vibrating linear molecules in classical trajectory simulation Park ST, Moon JH, Kim MS
9907 - 9920	Diffusion-controlled reactions in an electric field: Effects of an external boundary and competition between sinks Traytak SD, Tachiya M
9921 - 9928	New He-CO interaction energy surface with vibrational coordinate dependence .1. Ab initio potential and infrared spectrum Heijmen TGA, Moszynski R, Wormer PES, vanderAvoird A
9929 - 9934	A new He-CO interaction energy surface with vibrational coordinate dependence .2. The vibrational deactivation of CO(v=1) by inelastic collisions with He-3 and He-4 Reid JP, Simpson CJSM, Quiney HM
9935 - 9941	Control of molecular chirality Shao JS, Hanggi P
9942 - 9953	Theoretical and experimental studies of CIDNP kinetics in recombination of radical pairs by the method of switched external magnetic field .1. Theory Parnachev A, Purtov P, Bagryanskaya E, Sagdeev R
9954 - 9959	Artificial neural network applied for predicting rainbow trajectories in atomic and molecular classical collisions Braga AP, Braga JP, Belchior JC
9960 - 9965	Approximations based on the adiabatic treatment of rotation for resonances Qi JX, Bowman JM
9966 - 9974	A complete active space valence bond method with nonorthogonal orbitals Hirao K, Nakano H, Nakayama K
9975 - 9979	Accurate relativistic effective potentials for the sixth-row main group elements Wildman SA, DiLabio GA, Christiansen PA
9980 - 9984	Spin-restricted Brueckner orbitals for coupled-cluster wavefunctions Crawford TD, Lee TJ, Handy NC, Schaefer HF
9985 - 9993	The simulation of outgoing-wave boundary conditions via a symmetrically damped, Hermitian Hamiltonian operator Yu HG, Smith SC
9994 - 10002	Excitation energies from density functional perturbation theory Filippi C, Umrigar CJ, Gonze X
10003 - 10013	Chebyshev expansion methods for electronic structure calculations on large molecular systems Baer R, HeadGordon M
10014 - 10028	Conical intersections between the two lowest (1)A' potential energy surfaces of HCN, and the role of three-body effects Varandas AJC, Voronin AI, Jimeno P
10029 - 10043	Geometric and electronic structures of silicon-sodium binary clusters .2. Photoelectron spectroscopy of SinNm- cluster anions Kishi R, Kawamata H, Negishi Y, Iwata S, Nakajima A, Kaya K
10044 - 10050	Direct determination of localized Hartree-Fock orbitals as a step toward N scaling procedures Rubio J, Povill A, Malrieu JP, Reinhardt P
10051 - 10061	Ab initio MO studies of neutral and anionic SiCn clusters (n=2-5) Gomei M, Kishi R, Nakajima A, Iwata S, Kaya K
10062 - 10066	Electron-electron coalescence and counterbalance densities for atoms in Hartree-Fock theory Koga T, Matsuyama H
10067 - 10074	Giant lifetimes of optically excited states and the elusive structure of sodiumnitroprusside Delley B, Schefer J, Woike T
10075 - 10084	Density functional crystal orbital study on the normal vibrations of polyacetylene and polymethineimine Hirata S, Iwata S
10085 - 10095	Quantum study of the Li+HF->LiF+H reaction Aguado A, Paniagua M, Lara M, Roncero O
10096 - 10101	Angular distribution functions and specific local structures in liquid water DeSantis A, Rocca D
10102 - 10111	Phase diagrams of scalemic mixtures: A Monte Carlo simulation study Vlot MJ, vanMiltenburg JC, Oonk HAJ, vanderEerden JP
10112 - 10120	A free-energy landscape model for primary relaxation in glass-forming liquids: Rotations and dynamic heterogeneities Diezemann G
10121 - 10130	Local parabolic reference approximation of thermal Feynman path integrals in quantum Monte Carlo simulations Chao CE, Andersen HC
10131 - 10140	Periodic boundary conditions and the fast multipole method Challacombe M, White C, HeadGordon M
10141 - 10153	Scattering functions for multicomponent mixtures of charged hard spheres, including the polydisperse limit: Analytic expressions in the mean spherical approximation Gazzillo D, Giacometti A, Carsughi F
10154 - 10165	The Gibbs-Thomson effect and intergranular melting in ice emulsions: Interpreting the anomalous heat capacity and volume of supercooled water Johari GP
10166 - 10176	Computer simulations of liquid HF by a newly developed polarizable potential model Jedlovszky P, Vallauri R
10177 - 10184	Thermodynamically driven incompressible fluid mixtures Otto F, Weinan E
10185 - 10190	The growth mechanism of (-Cu-O-) strings on a Ag(110) surface studied by scanning tunneling microscopy, x-ray photoelectron spectroscopy, and high resolution electron energy loss spectroscopy Matsumoto Y, Sakamoto K, Okawa Y, Suto S, Tanaka K
10191 - 10200	Stress overshoot in a model particle gel Whittle M, Dickinson E
10201 - 10206	Rotational conformational energetics of stiff aromatic polyimides: Effects of exchange repulsions, dipole-moiety interactions, and pi-conjugations Cui CZ, Cho SJ, Kim KS, Baehr C, Jung JC
10207 - 10213	Exact results and mean field approximation for a model of molecular aggregation Duque D, Tarazona P
10214 - 10224	Concentration dependence of static chain properties 2, off-lattice Monte Carlo simulations Olaj OF, Petrik T, Zifferer G
10225 - 10228	Electron paramagnetic resonance study of the concentration of spin-label molecules in hydrated glass pores Cevc P, Choi C, Holly R, Pintar MM
10229 - 10241	Dissociative chemisorption of methane on Ir(111): Evidence for direct and trapping-mediated mechanisms Seets DC, Reeves CT, Ferguson BA, Wheeler MC, Mullins CB
10242 - 10252	Cooperativity in binding of proteins to DNA BenNaim A
10253 - 10259	Low temperature viscosity in elongated ferrofluids Alarcon T, PerezMadrid A, Rubi JM
10260 - 10267	Electro-deposition of polymer chains on an adsorbing wall: Density profiles and wall coverage Foo GM, Pandey RB
10268 - 10277	Penetration depth of photomobilized F atoms in Ar layers from a sandwich experiment Bressler C, Dickgiesser M, Schwentner N
10278 - 10287	Nanostructured silicon films obtained by neutral cluster depositions Melinon P, Keghelian P, Prevel B, Perez A, Guiraud G, LeBrusq J, Lerme J, Pellarin M, Broyer M
10288 - 10310	Dynamics of lipid bilayers from comparative analysis of H-2 and C-13 nuclear magnetic resonance relaxation data as a function of frequency and temperature Nevzorov AA, Brown MF
10311 - 10315	Comparative study of wormlike polymer solutions using statistical mechanics, two-parameter theory, and blob theory Dondos A
10316 - 10326	Shear behavior of squalane and tetracosane under extreme confinement .1. Model, simulation method, and interfacial slip Gupta SA, Cochran HD, Cummings PT
10327 - 10334	Shear behavior of squalane and tetracosane under extreme confinement .2. Confined film structure Gupta SA, Cochran HD, Cummings PT
10335 - 10343	Shear behavior of squalane and tetracosane under extreme confinement .3. Effect of confinement on viscosity Gupta SA, Cochran HD, Cummings PT
10344 - 10347	Direct measurement of eigenstate-resolved unimolecular dissociation rates of HOCl Wedlock MR, Jost R, Rizzo TR
10348 - 10349	Rotational energy transfer of CH in the B (v=0) state by collisions with Ar and N2O using a time-resolved Fourier Transform spectrometer Wang CC, Chin TL, Lin KC
10350 - 10350	Heterogeneous two-dimensional nucleation and growth kinetics -Comment Nelson J
10351 - 10352	Heterogeneous two-dimensional nucleation and growth kinetics -Response Liu XY, Tsukamoto K
10353 - 10353	The effects of internal constraints on the configurations of chain molecules (vol 92, pg 3118, 1990) Chan HS, Dill KA