Journal of Chemical Physics

Journal of Chemical Physics, Vol.117, No.14 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (61 articles)

6389 - 6401	Self-consistent nonperturbative theory: Application to a two-dimensional square-well system Serrano-Illan J, Mederos L, Navascues G, Velasco E
6402 - 6410	Electron excitation energies using a consistent third-order propagator approach: Comparison with full configuration interaction and coupled cluster results Trofimov AB, Stelter G, Schirmer J
6411 - 6416	Perturbation theory of the electron correlation cusp based on a partitioning of the electron-electron interaction into long-and short-range components Sirbu I, King HF
6417 - 6428	Ab initio study of magnetochiral birefringence Coriani S, Pecul M, Rizzo A, Jorgensen P, Jaszunski M
6429 - 6438	Quantum optimal control of unbounded molecular dynamics: Application to NaI predissociation Nakagami K, Ohtsuki Y, Fujimura Y
6439 - 6445	Ab initio predictions of the spectroscopic parameters of the silicon halomethylidyne (Si = C-X; X=F,Cl,Br) free radicals Evans CJ, Clouthier DJ
6446 - 6449	Spectroscopic detection of the SiCCl free radical Smith TC, Evans CJ, Clouthier DJ
6450 - 6454	Electron-impact ionization of the methyl halides Rejoub R, Lindsay BG, Stebbings RF
6455 - 6462	State-to-state differential cross sections for spin-multiplet-changing collisions of NO(X (2)Pi(1/2)) with argon Elioff MS, Chandler DW
6463 - 6468	Discrimination of hydrogen-bonded complexes with axial chirality Alkorta I, Elguero J
6469 - 6477	Time-dependent wave packet dynamics of the H+HLi reactive scattering Padmanaban R, Mahapatra S
6478 - 6488	Exploring the OH+CO -> H+CO2 potential surface via dissociative photodetachment of (HOCO)(-) Clements TG, Continetti RE, Francisco JS
6489 - 6492	Symmetry analysis of internal rotation Szalay V, Csaszar AG, Senent ML
6493 - 6499	Gas phase infrared spectroscopy of cluster anions as a function of size: The effect of solvation on hydrogen-bonding in Br-center dot(HBr)(1,2,3) clusters Pivonka NL, Kaposta C, von Helden G, Meijer G, Woste L, Neumark DM, Asmis KR
6500 - 6510	Femtosecond velocity map imaging of concerted photodynamics in CF2I2 Roeterdink WG, Janssen MHM
6511 - 6518	Disclosing rovibrational couplings and overlaps from irregularities in action spectra: Photodissociation of the 4 nu(CH) rovibrational manifold of C2H2 Sheng XZ, Ganot Y, Rosenwaks S, Bar I
6519 - 6523	Theoretical investigation on the N+SF2 -> NS+ reaction involving resonance-enhanced multiphoton ionization process Liu YJ, Huang MB, Zhou XG, Li QX, Yu SQ
6524 - 6532	A core-level photoionization study of furan Rennie EE, Hergenhahn U, Kugeler O, Rudel A, Marburger S, Bradshaw AM
6533 - 6537	Ionized and excited states of ferrocene: Symmetry adapted cluster-configuration-interaction study Ishimura K, Hada M, Nakatsuji H
6538 - 6545	High-resolution infrared spectra of the C-H asymmetric stretch vibration of jet-cooled methoxy radical (CH3O) Han JX, Utkin YG, Chen HB, Burns LA, Curl RF
6546 - 6555	Nonresonant two-photon mass analyzed threshold ionization and zero kinetic energy photoelectron investigation of the (X)over-tilde B-2(1) ground state of CH2CO+ and CD2CO+ Wang SL, Shi YJ, Jakubek ZJ, Barnett M, Simard B, Muller-Dethlefs K, Liu CP, Lee YP
6556 - 6561	Semiclassical calculation of collisional dissociation cross sections for N+N-2 Tully C, Johnson RE
6562 - 6572	Rovibrational structure of the Ar-CO complex based on a novel three-dimensional ab initio potential Pedersen TB, Cacheiro JL, Fernandez B, Koch H
6573 - 6581	The development of effective classical potentials and the quantum statistical mechanical second virial coefficient of water Schenter GK
6582 - 6589	Dynamics in supercooled polyalcohols: Primary and secondary relaxation Doss A, Paluch M, Sillescu H, Hinze G
6590 - 6598	Perturbed hard-body fluid analysis of the global effects of solvation on conformational thermodynamics McClain BL, Ben-Amotz D
6599 - 6606	Rotational energy relaxation of polar diatomic molecules diluted in simple liquids Padilla A, Perez J, Hernandez AC
6607 - 6613	Denucleation rates during Ostwald ripening: Distribution kinetics of unstable clusters Madras G, McCoy BJ
6614 - 6617	Femtosecond time-resolved excited state dynamics of cyanine encapsulated by beta-cyclodextrin Huang WT, Wang SF, Yang H, Gong QH, Xu GZ, Xiang JF, Chen CP, Yan WP
6618 - 6628	A Monte Carlo study of spectroscopy in nanoconfined solvents Thompson WH
6629 - 6636	Molecular dynamics simulation of liquid N2O4 reversible arrow 2NO(2) by orientation-sensitive pairwise potential. II. Vibrational dephasing of the dissociation mode Kato T
6637 - 6645	Computer simulations of the dynamics of doubly occupied N-2 clathrate hydrates van Klaveren EP, Michels JPJ, Schouten JA, Klug DD, Tse JS
6646 - 6654	Germing surfaces in reaction-diffusion systems? Experiments and a hypothesis Hantz P
6655 - 6661	Isomers of S2O: Infrared absorption spectra of cyclic S2O in solid Ar Lo WJ, Wu YJ, Lee YP
6662 - 6666	Influence of temperature on percolation in a simple model of flexible chains adsorption Kondrat G
6667 - 6672	Vacuum ultraviolet surface photochemistry of water adsorbed on graphite Baggott SR, Kolasinski KW, Perdigao LMA, Riedel D, Guo QM, Palmer RE
6673 - 6687	Signatures of site-specific reaction of H-2 on Cu(100) Somers MF, McCormack DA, Kroes GJ, Olsen RA, Baerends EJ, Mowrey RC
6688 - 6698	Nanoscopic interchain aggregate domain formation in conjugated polymer films studied by third harmonic generation near-field scanning optical microscopy Schaller RD, Snee PT, Johnson JC, Lee LF, Wilson KR, Haber LH, Saykally RJ, Nguyen TQ, Schwartz BJ
6699 - 6704	Quasiwetting and morphological phase transitions in confined far-from-equilibrium magnetic thin films Candia J, Albano EV
6705 - 6714	Homogeneous nucleation of droplets from a supersaturated vapor phase Moody MP, Attard P
6715 - 6720	Interdiffusion in core-shell and quantum-dot-quantum-well nanocrystals Stirner T
6721 - 6729	Surface control of optical properties in silicon nanoclusters Puzder A, Williamson AJ, Grossman JC, Galli G
6730 - 6736	Compression and caging of CD3Cl by H2O layers on Ru(001) Lilach Y, Asscher M
6737 - 6744	Atomic and molecular adsorption on Rh(111) Mavrikakis M, Rempel J, Greeley J, Hansen LB, Norskov JK
6745 - 6756	Exactly solvable Ogston model of gel electrophoresis. IX. Generalizing the lattice model to treat high field intensities Gauthier MG, Slater GW
6757 - 6765	Effects of quenched impurities on surface diffusion, spreading, and ordering of O/W(110) Nikunen P, Vattulainen I, Ala-Nissila T
6766 - 6779	Coupled ion-interface dynamics and ion transfer across the interface of two immiscible liquids Kornyshev AA, Kuznetsov AM, Urbakh M
6780 - 6788	Anomalous inverse absorption features in the far-infrared RAIRS spectra of SnCl4 on thin-film SnO2 surfaces Pilling MJ, Le Vent S, Gardner P, Awaluddin A, Wincott PL, Pemble ME, Surman M
6789 - 6793	Universal shape ratios for polymers grafted at a flat surface Causo MS
6794 - 6802	Green emission from poly(fluorene)s: The role of oxidation Zojer E, Pogantsch A, Hennebicq E, Beljonne D, Bredas JL, de Freitas PS, Scherf U, List EJW
6803 - 6809	Statistical thermodynamics of lattice polymer fluid Li XY, Zhao DL
6810 - 6820	Dynamics and rheology of inhomogeneous polymeric fluids: A complex Langevin approach Fredrickson GH
6821 - 6832	Inter-peptide interaction and delocalization of amide I vibrational excitons in myoglobin and flavodoxin Choi JH, Ham S, Cho M
6833 - 6840	Peptide conformational heterogeneity revealed from nonlinear vibrational spectroscopy and molecular-dynamics simulations Woutersen S, Pfister R, Hamm P, Mu YG, Kosov DS, Stock G
6841 - 6851	Equilibrium polymerization of cyclic carbonate oligomers. III. Chain branching and the gel transition Ballone P, Jones RO
6852 - 6862	Polymer nanodroplets adsorbed on nanocylinders: A Monte Carlo study Milchev A, Binder K
6863 - 6872	Brownian dynamics studies on DNA gel electrophoresis. I. Numerical method and "periodic" behavior of elongation-contraction motions Azuma R, Takayama H
6873 - 6879	Brownian dynamics studies on DNA gel electrophoresis. II. "Defect" dynamics in the elongation-contraction motion Azuma R
6880 - 6880	Methylation effects in state resolved quenching of highly vibrationally excited azabenzenes (E-vib similar to 38 500 cm(-1)). I. Collisions with water (vol 115, pg 6990, 2001) Elioff MS, Fang M, Mullin AS
6881 - 6881	The potential energy curve and dipole polarizability tensor of mercury dimer (vol 115, pg 7401, 2001) Schwerdtfeger P, Wesendrup R, Moyano GE, Sadlej AJ, Greif J, Hensel F
6882 - 6893	The electronic influence of a third body on resonance energy transfer (vol 116, pg 6701, 2002) Daniels GJ, Andrews DL