화학공학소재연구정보센터

Journal of Chemical Physics

Journal of Chemical Physics, Vol.107, No.15 Entire volume, number list
ISSN: 0021-9606 (Print) 

In this Issue (41 articles)

5635 - 5644 An instantaneous normal mode theory of condensed phase absorption: The collision-induced absorption spectra of liquid CO2
Moore P, Space B
5645 - 5651 The (A)over-tilde(2)A(1)-(X)over-tilde(2)B(1) transition of H2O+ in the near infrared region
Huet TR, Bachir IH, Destombes JL, Vervloet M
5652 - 5660 Theoretical evaluation of medium effects on absorption maxima of molecular solutes .1. Formulation of a new method based on the self-consistent reaction field theory
Houjou H, Sakurai M, Inoue Y
5661 - 5675 Jet-cooled molecular radicals in slit supersonic discharges: Sub-Doppler infrared studies of methyl radical
Davis S, Anderson DT, Duxbury G, Nesbitt DJ
5676 - 5683 Spectroscopic characterization of the singly excited CaAr(4d pi (3)Pi(0)), CaAr(4d delta (3)Delta(1)) states and the doubly excited CaAr(4p pi 4p pi (3)Sigma(-)) state
Kaup JG, Breckenridge WH
5684 - 5693 Electronic spectra of dipolar solutes at liquid/liquid interfaces: Effect of interface structure and polarity
Michael D, Benjamin I
5694 - 5701 Sub-doppler study of the v(3)=2 state of SF6 by infrared-infrared double resonance with a sideband spectrometer
Khelkhal M, Rusinek E, Legrand J, Herlemont F, Pierre G
5702 - 5713 A study of the ArCl2 Van der Waals complex: Ab initio-based potential energy surfaces, the relative stability of conformers, and the''hidden'' microwave spectrum
Naumkin FY, McCourt FRW
5714 - 5719 Free jet absorption millimeter wave spectrum and van der Waals potential energy surface of the 2,3-dihydrofuran-argon adduct
Maris A, Melandri S, Caminati W, Favero PG, Makarewicz J
5720 - 5726 Determination of the I-2 bond-length distribution in liquid, solid and solution, by extended x-ray absorption fine structure spectroscopy
Buontempo U, DiCicco A, Filipponi A, Nardone M, Postorino P
5727 - 5739 Excited state dynamics with nonadiabatic transitions for model photoinduced proton-coupled electron transfer reactions
Fang JY, HammesSchiffer S
5740 - 5747 Li+ solvation in ethylene carbonate-propylene carbonate concentrated solutions: A comprehensive model
Cazzanelli E, Croce F, Appetecchi GB, Benevelli F, Mustarelli P
5748 - 5756 Efficient calculation of free-energy barriers in quantum activated processes. A path-integral centroid approach
Ramirez R
5757 - 5770 Photodissociation of CH2 .6. Three-dimensional quantum dynamics of the dissociation through the coupled 2A'' and 3A'' states
Kroes GJ, vanHemert MC, Billing GD, Neuhauser D
5771 - 5775 Solvation and the excited states of formamide
Krauss M, Webb SP
5776 - 5779 Silacyanogen
Ignatyev IS, Schaefer HF
5780 - 5787 Differences between the exact sum-over-states and the canonical approximation for the calculation of static and dynamic hyperpolarizabilities
Bishop DM, Kirtman B, Champagne B
5788 - 5793 Ab initio theoretical study of dipole-bound anions of molecular complexes. Water trimer anion
Smith DMA, Smets J, Elkadi Y, Adamowicz L
5794 - 5803 The dissociation of dimeric aliphatic acids: Energetics and relaxation kinetics
Wilcox CF, Bauer SH
5804 - 5810 Volume dependence of potential energy landscapes in glasses
Malandro DL, Lacks DJ
5811 - 5814 Transition state theory and grand canonical partition functions
Kostin MD
5815 - 5820 Cavity formation energy in hard sphere fluids: An asymptotically correct expression
Matyushov DV, Ladanyi BM
5821 - 5839 Optimal energy estimation in path-integral Monte Carlo simulations
Janke W, Sauer T
5840 - 5851 Symplectic splitting methods for rigid body molecular dynamics
Dullweber A, Leimkuhler B, McLachlan R
5852 - 5862 Decoupling of tracer diffusion from viscosity in a supercooled liquid near the glass transition
Bhattacharyya S, Bagchi B
5863 - 5878 Evaluation of quantum transition rates from quantum-classical molecular dynamics simulations
Prezhdo OV, Rossky PJ
5879 - 5889 Mesoscopic dynamics of copolymer melts: From density dynamics to external potential dynamics using nonlocal kinetic coupling
Maurits NM, Fraaije JGEM
5890 - 5897 A study on the structure of water in an aqueous solution by solvent effect on a volume phase transition of N-isopropylacrylamide gel and low-frequency Raman spectroscopy
Suzuki Y, Suzuki N, Takasu Y, Nishio I
5898 - 5906 Hydrodynamic surface waves in concentrated polymer solutions in the presence of surface adsorption
Wang GH, Huang QR
5907 - 5913 The dynamics of field-induced director reorientation for a nematic phase comprised of flexible molecules
Ciampi E, Emsley JW, Luckhurst GR, Timimi BA, Kothe G, Tittelbach M
5914 - 5917 Tight-binding recursion calculations of step energetics on the GaAs(110) surface
Kang HC, Chen XF, Tan HS
5918 - 5928 Experimental investigation and computational modeling of hot filament diamond chemical vapor deposition
Zumbach V, Schafer J, Tobai J, Ridder M, Dreier T, Schaich T, Wolfrum J, Ruf B, Behrendt F, Deutschman O, Warnatz J
5929 - 5944 Statistical-mechanically exact simulation of polymer conformation in an external field
Krishnaswami S, Ramkrishna D, Caruthers JM
5945 - 5947 Electrically induced phase inversion in urethane-modified polypropylene glycol/dimethylsiloxane blend
Kimura H, Aikawa K, Masubuchi Y, Takimoto J, Koyama K, Uemura T
5948 - 5951 Slow relaxation in interpenetrated networks
Chikina J, Daoud M
5952 - 5967 Structure and interaction of weakly charged polyelectrolyte brushes: Self-consistent field theory
Zhulina EB, Borisov OV
5968 - 5972 Trapping a precursor to chemisorption at 32 K-NH3 adsorption on Cu(110)
Mocuta D, Ahner J, Yates JT
5973 - 5978 Field-cycling nuclear magnetic resonance relaxometry of thermoreversible polybutadiene networks
Kimmich R, Gille K, Fatkullin N, Seitter R, Hafner S, Muller M
5979 - 5982 Optical-optical double-resonance spectroscopy of autoionizing states of water
Glab WL
5983 - 5986 Anisotropic translational cooling: Velocity dependence of collisional alignment in a seeded supersonic expansion
Harich S, Wodtke AM
5987 - 5987 Energy switching approach to potential surfaces: An accurate single-valued function for the water molecule (vol 105, pg 3524, 1996)
Varandas AJC