Journal of Chemical Physics

Journal of Chemical Physics, Vol.119, No.16 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (60 articles)

8213 - 8216	Dynamics of the O(D-1)+CO2 oxygen isotope exchange reaction Perri MJ, Van Wyngarden AL, Boering KA, Lin JJ, Lee YT
8217 - 8224	Split-localized orbitals can yield stronger configuration interaction convergence than natural orbitals Bytautas L, Ivanic J, Ruedenberg K
8225 - 8228	Intermolecular forces and fixed-node diffusion Monte Carlo: A brute force test of accuracies for He-2 and He-LiH Mella M, Anderson JB
8229 - 8234	Improved leap-size selection for accelerated stochastic simulation Gillespie DT, Petzold LR
8235 - 8249	Tunneling dissociation from a double well via path integrals Douvropoulos TG, Nicolaides CA
8250 - 8256	Nonlocal dielectric functions on the nanoscale: Screened forces from unscreened potentials Jenkins OS, Hunt KLC
8257 - 8265	Local expansion of N-representable one-particle density matrices yielding a prescribed electron density Pipek J, Nagy S
8266 - 8275	(3)Sigma(-) and (3)Pi states of GeC and GeSi: The problematic dissociation energy of GeC Sari L, Yamaguchi Y, Schaefer HF
8276 - 8288	Quantum and classical structures for He-4 clusters with the H- impurity Sebastianelli F, Di Paola C, Baccarelli I, Gianturco FA
8289 - 8296	Mode-correlated product pairs in the F+CHD3 -> DF+CHD2 reaction Zhou JG, Lin JJ, Liu KP
8297 - 8304	Theoretical predictions of the decomposition mechanism of 1,3,3-trinitroazetidine (TNAZ) Alavi S, Reilly LM, Thompson DL
8305 - 8310	Structural properties of CuO4 and CuO5 clusters: A density functional study Massobrio C, Pouillon Y
8311 - 8320	On the electronic structures of gaseous transition metal halide complexes, FeX4- and MX3- (M=Mn, Fe, Co, Ni, X=Cl, Br), using photoelectron spectroscopy and density functional calculations Yang X, Wang XB, Wang LS, Niu SQ, Ichiye T
8321 - 8326	Resonant two-photon ionization spectroscopy of the van der Waals complex C6H5CH3 center dot center dot center dot N-2: Structure, binding energy, intermolecular vibrations, and internal rotation Hu YH, Yang SH
8327 - 8334	Fundamental limits on two-photon absorption cross sections Kuzyk MG
8335 - 8346	Time-dependent currents through small molecules using wide-band and narrow-band approximations Burrows BL, Amos AT
8347 - 8355	State-resolved dissociation dynamics of glyoxal near the threshold for formation of fragment HCO Chen MW, Lee SJ, Chen IC
8356 - 8365	Selective detection of isomers with photoionization mass spectrometry for studies of hydrocarbon flame chemistry Cool TA, Nakajima K, Mostefaoui TA, Qi F, McIlroy A, Westmoreland PR, Law ME, Poisson L, Peterka DS, Ahmed M
8366 - 8372	Reactions of phenylium ions C-6(H,D)(5)(+) with D-2 Ascenzi D, Bassi D, Franceschi P, Tosi P, Di Stefano M, Rosi M, Sgamellotti A
8373 - 8378	Application of a VUV Fourier transform spectrometer and synchrotron radiation source to measurements of. VI. The epsilon(0,0) band of NO Cheung ASC, Wong AL, Lo DHY, Leung KWS, Yoshino K, Thorne AP, Murray JE, Imajo T, Ito K, Matsui T
8379 - 8396	Ab initio studies of He-HCCCN interaction Akin-Ojo O, Bukowski R, Szalewicz K
8397 - 8403	Effect of solvent on molecular conformation: Microwave spectra and structures of 2-aminoethanol van der Waals complexes Tubergen MJ, Torok CR, Lavrich RJ
8404 - 8416	Microwave spectrum, structure, and internal motion of the open-shell van der Waals complex Ar-ClO2 Schafer M, Ha TK, Bauder A
8417 - 8423	Theoretical study of the static first hyperpolarizability of azo-enaminone compounds de Oliveira HCB, Fonseca TL, Castro MA, Amaral OAV, Cunha S
8424 - 8436	Experimental and theoretical investigation of the c (1)Pi-a (1)Delta transition of NH/D-Ne Kerenskaya G, Schnupf U, Heaven MC
8437 - 8448	Dynamics of radiationless transitions in large molecular systems: A Franck-Condon-based method accounting for displacements and rotations of all the normal coordinates Borrelli R, Peluso A
8449 - 8463	Microwave and ab initio studies of the internal rotation of ethylene in the Ar-ethylene and Ne-ethylene van der Waals complexes Liu YQ, Jager W
8464 - 8472	On the applicability of the step function nonradiative lifetime model for diffusion controlled reactions Litniewski M, Gorecki J
8473 - 8481	Experimental realization of a fetching algorithm in a 7-qubit NMR spin Liouville space computer Long GL, Xiao L
8482 - 8491	Analysis of the contributions of three-body potentials in the equation of state of He-4 Ujevic S, Vitiello SA
8492 - 8499	Hybrid quantum chemical studies for the methanol formation reaction assisted by the proton transfer mechanism in supercritical water: CH3Cl+nH(2)O -> CH3OH+HCl+(n-1)H2O Hori T, Takahashi H, Nitta T
8500 - 8510	Selecting the information content of two-dimensional Raman spectra in liquids Ma A, Stratt RM
8511 - 8518	Conductivity of molten sodium chloride in an alternating electric field Petravic J, Delhommelle J
8519 - 8525	Indirect (J) coupling of inequivalent As-75 nuclei in crystalline and glassy As2Se3 and As2S3 Whitaker J, Ahn E, Hari P, Williams GA, Taylor PC, Facelli JC
8526 - 8536	Critical parameters of unrestricted primitive model electrolytes with charge asymmetries up to 10 : 1 Cheong DW, Panagiotopoulos AZ
8537 - 8541	Intermolecular exchange of vibrational population in a binary liquid mixture Graener H, Patzlaff T, Paradowska-Moszkowska K, Seifert G
8542 - 8548	Study of supercritical krypton by small-angle neutron scattering: Analysis of the cross-over region Bonetti M, Calmettes P, Bervillier C
8549 - 8557	Quasielastic neutron scattering characterization of the relaxation processes in a room temperature ionic liquid Triolo A, Russina O, Arrighi V, Juranyi F, Janssen S, Gordon CM
8558 - 8566	Complex formation in binary propionic acid-triethylamine mixtures: A dielectric relaxation and titration study Orzechowski K, Pajdowska M, Fuchs K, Kaatze U
8567 - 8576	Raman band shape analysis of a low temperature molten salt Cavalcante AO, Ribeiro MCC
8577 - 8591	Brillouin and boson peaks in glasses from vector Euclidean random matrix theory Ciliberti S, Grigera TS, Martin-Mayor V, Parisi G, Verrocchio P
8592 - 8605	Forward-backward semiclassical dynamics for quantum fluids using pair propagators: Application to liquid para-hydrogen Nakayama A, Makri N
8606 - 8625	A continuum theory of solvation in quadrupolar solvents. I. Formulation Jeon J, Kim HJ
8626 - 8635	A continuum theory of solvation in quadrupolar solvents. II. Solvation free energetics, dynamics, and solvatochromism Jeon J, Kim HJ
8636 - 8644	The rotational motion and electronic relaxation of the Gd(III) aqua complex in water revisited through a full proton relaxivity study of a probe solute Fries PH, Ferrante G, Belorizky E, Rast S
8645 - 8662	Generalized corresponding states model for bulk and interfacial properties in pure fluids and fluid mixtures Kiselev SB, Ely JF
8663 - 8675	Effects of weak surface fields on the density profiles and adsorption of a confined fluid near bulk criticality Maciolek A, Evans R, Wilding NB
8676 - 8685	Surfactant-stabilized structures in confined liquids Overduin SD, Patey GN
8686 - 8694	Photoluminescence and radiationless processes in Mn2+-doped Ca1-xSrxF2 fluorites as a function of pressure and temperature. A structural correlation study Rodriguez F, Hernandez I, Moreno M, Alcala R
8695 - 8703	Densification effects on structural relaxation of polyolefins Clark J, Maranas JK
8704 - 8715	Density functional and Monte Carlo studies of sulfur. II. Equilibrium polymerization of the liquid phase Ballone P, Jones RO
8716 - 8729	Analyzing the biopolymer folding rates and pathways using kinetic cluster method Zhang WB, Chen SJ
8730 - 8735	Glass transition of small polystyrene spheres in aqueous suspensions Sasaki T, Shimizu A, Mourey TH, Thurau CT, Ediger MD
8736 - 8746	Monte Carlo simulations of infinitely dilute solutions of amphiphilic diblock star copolymers Connolly R, Timoshenko EG, Kuznetsov YA
8747 - 8760	Viscoelasticity and rheology of depletion flocculated gels and fluids Shah SA, Chen YL, Schweizer KS, Zukoski CF
8761 - 8762	Canonical perturbation theory versus Born-Oppenheimer-type separation of motions: The vibrational dynamics of C-3 Robert J, Joyeux M
8763 - 8764	On the role of the electron density difference in the interpretation of molecular properties Harrison JF
8765 - 8766	Comment on "The cohesive energetics of solid cesium chloride" [J. Chem. Phys. 118, 2308 (2003)] Aguado A
8767 - 8768	Response to "Comment on'The cohesive energetics of cesium chloride [J. Chem. Phys. 118, 2308 (2003)]' " Pyper NC
8769 - 8769	Coherent population transfer in molecules coupled with a dissipative environment by intense ultrashort chirped pulse (vol 117, pg 7222, 2002) Fainberg BD, Gorbunov VA