Journal of Chemical Physics

Journal of Chemical Physics, Vol.112, No.11 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (39 articles)

4901 - 4909	Convergent summation of Moller-Plesset perturbation theory Goodson DZ
4910 - 4922	Approximate calculation of femtosecond pump-probe spectra monitoring nonadiabatic excited-state dynamics Dilthey S, Hahn S, Stock G
4923 - 4934	Critical points and reaction paths characterization on a potential energy hypersurface Ramquet MN, Dive G, Dehareng D
4935 - 4941	Are properties derived from variance-optimized wave functions generally more accurate? Monte Carlo study of non-energy-related properties of H-2, He, and LiH Snajdr M, Rothstein SM
4942 - 4951	Infrared spectroscopy of ArOH: A direct probe of the Ar plus OH X-2 Pi potential energy surface Bonn RT, Wheeler MD, Lester MI
4952 - 4958	Ab initio potential energy surface for the Ar(S-1) plus OH(X-2 Pi) interaction and bound rovibrational states Klos J, Chalasinski G, Berry MT, Kendall RA, Burcl R, Szczesniak MM, Cybulski SM
4959 - 4965	A selected ion flow tube study of the reactions of small CmHn+ ions with O atoms Scott GBI, Milligan DB, Fairley DA, Freeman CG, McEwan MJ
4966 - 4973	Negative ion photoelectron spectroscopy of OH-(NH3) Schwartz RL, Davico GE, Kim JB, Lineberger CW
4974 - 4982	Photodissociation spectroscopy of the Ca+-Ne complex Reddic JE, Pullins SH, Duncan MA
4983 - 4993	An energy-resolved study of the partial fragmentation dynamics of Ar-HCl into H+Ar-Cl after ultraviolet photodissociation Juanes-Marcos JC, Garcia-Vela A
4994 - 5001	Crossed beam reaction of phenyl radicals with unsaturated hydrocarbon molecules. I. Chemical dynamics of phenylmethylacetylene (C6H5CCCH3;X (1)A(＇)) formation from reaction of C6H5(X (2)A(1)) with methylacetylene, CH3CCH(X (1)A(1)) Kaiser RI, Asvany O, Lee YT, Bettinger HF, Schleyer PV, Schaefer HF
5002 - 5011	Coupling between the internal rotation of the methyl group and proton/deuteron transfer in jet-cooled 5-methyl-9-hydroxyphenalenone(OH) and 5-methyl-9-hydroxyphenalenone(OD): Tunneling rate dependence of coupling potential Nishi K, Sekiya H, Mochida T, Sugawara T, Nishimura Y
5012 - 5020	Anisotropic Coulomb explosion of C-60 irradiated with a high-intensity femtosecond laser pulse Kou JK, Zhakhovskii V, Sakabe S, Nishihara K, Shimizu S, Kawato S, Hashida M, Shimizu K, Bulanov S, Izawa Y, Kato Y, Nakashima N
5021 - 5036	Theoretical description of the nonlinear response functions associated with eight distinctive three-dimensional vibrational spectroscopies Park K, Cho MH
5037 - 5043	Experimental and theoretical study of the electronic spectrum of the BAr2 complex: Transition to the excited valence B(2s2p(2) D-2) state Krumrine JR, Alexander MH, Yang X, Dagdigian PJ
5044 - 5053	An accurate semiclassical calculation of collision-induced dissociation Sakimoto K
5054 - 5059	Quantum dynamics of photoexcited cyclohexadiene introducing reactive coordinates Hofmann A, de Vivie-Riedle R
5060 - 5069	Studying vibrational wavepacket dynamics by measuring fluorescence interference fluctuations Warmuth C, Tortschanoff A, Milota F, Shapiro M, Prior Y, Averbukh IS, Schleich W, Jakubetz W, Kauffmann HF
5070 - 5080	Vibrations of the carbon dioxide dimer Chen H, Light JC
5081 - 5090	Driving wave packet recurrences with optimally modulated laser pulses Goodson BM, Goswami D, Rabitz H, Warren WS
5091 - 5094	Equivalence between the "classical" and the "Warren" approaches for the effects of long range dipolar couplings in liquid nuclear magnetic resonance Jeener J
5095 - 5099	Demonstration of quantum logic gates in liquid crystal nuclear magnetic resonance Marjanska M, Chuang IL, Kubinec MG
5100 - 5104	Critical localization of confined phonons in finite size admonolayers Pouthier V, Girardet C
5105 - 5112	Analysis of the intramolecular charge transfer in donor-acceptor alpha,alpha ＇-substituted oligothiophenes from their vibrational spectra Hernandez V, Casado J, Effenberger F, Navarrete JTL
5113 - 5120	Fourier transform infrared isotopic study of the C-12 chain trapped in solid Ar Ding XD, Wang SL, Rittby CML, Graham WRM
5121 - 5126	Line of triple points for the hard-core Yukawa model: A computer simulation study El Azhar F, Baus M, Ryckaert JP, Meijer EJ
5127 - 5132	Vibrational dynamics of hydrogen-bonded HCl-diethyl ether complexes Giebels IAME, van den Broek MAFH, Kropman MF, Bakker HJ
5133 - 5143	Structures and stability of CO layers on the MgO(001) surface Sallabi AK, Jack DB
5144 - 5157	An energy-based mapping method for identifying the in-plane orientations of polypeptides and other macromolecules at crystalline interfaces Dai YH, Evans JS
5158 - 5167	Accurate ab initio determination of magnetic interactions and hopping integrals in La2-xSrxCuO4 systems Calzado CJ, Sanz JF, Malrieu JP
5168 - 5174	Computer simulation studies of a square-well fluid in a slit pore. Spreading pressure and vapor-liquid phase equilibria using the virtual-parameter-variation method Vortler HL, Smith WR
5175 - 5180	Geometry dependent critical exponents at complete wetting Rascon C, Parry AO
5181 - 5189	Analysis of the susceptibility minimum observed in 0.4Ca(NO3)(2)-0.6KNO(3) by dielectric spectroscopy and light scattering Casalini R, Ngai KL, Roland CM
5190 - 5204	Fluorine atom abstraction by Si(100) II. Model Tate MR, Pullman DP, Li YL, Gosalvez-Blanco D, Tsekouras AA, Ceyer ST
5205 - 5211	Effect of H-bond active sites on transport properties of poly(ethylene oxide) dissolved in its monomers: Shear viscosity and diffusion coefficient studies Crupi V, Faraone A, Maisano G, Majolino D, Migliardo P, Venuti V, Villari V
5212 - 5222	Self-organization and mismatch tolerance in protein folding: General theory and an application Fernandez A, Berry RS
5223 - 5229	Coarsely resolved topography along protein folding pathways Fernandez A, Kostov KS, Berry RS
5230 - 5241	The nonplanarity of the peptide group: Molecular dynamics simulations with a polarizable two-state model for the peptide bond Rick SW, Cachau RE
5242 - 5243	A new density functional approach to nonuniform Lennard-Jones fluids Zhou SQ, Ruckenstein E