화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.102, No.16 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (14 articles)

2635 - 2640 Stabilization energies and rotational motions in clathrate hydrate of benzene studied by molecular dynamics simulations
Fujii K, Arata Y, Tanaka H, Nakahara M
2641 - 2649 EPR studies associated with the electrochemical reduction of C-60 and supramolecular complexes of C-60 in toluene-acetonitrile solvent mixtures
Olsen SA, Bond AM, Compton RG, Lazarev G, Mahon PJ, Marken F, Raston CL, Tedesco V, Webster RD
2650 - 2657 Study of small water clusters using the effective fragment potential model
Merrill GN, Gordon MS
2658 - 2666 Time-dependent fluorescence spectra of large molecules in polar solvents
Hsu CP, Georgievskii Y, Marcus RA
2667 - 2672 On the mechanism of the decomposition of acidic O-3 solutions, thermally or H2O2-initiated
Sehested K, Corfitzen H, Holcman J, Hart EJ
2673 - 2678 Water density effects on homogeneous water-gas shift reaction kinetics
Rice SF, Steeper RR, Aiken JD
2679 - 2684 Infrared and Raman spectroscopy of bis(4,4-dimethyl-2,5-cyclohexadien-1-ylidene). Vibrational assignment by Hartree-Fock and density functional theory calculations and depolarization method
Boo BH, Lee SY, Na HK
2685 - 2690 On the uncertainties in the rate coefficients for OH reactions with hydrocarbons, and the rate coefficients of the 1,3,5-trimethylbenzene and m-xylene reactions with OH radicals in the gas phase
Kramp F, Paulson SE
2691 - 2699 Density functional study of the conformations and vibrations of 1,2-dimethoxyethane
Yoshida H, Matsuura H
2700 - 2707 Molecular structure and conformational analysis of some alkylthio-substituted bithiophenes. Theoretical and experimental investigation
DiCesare N, Belletete M, Raymond F, Leclerc M, Durocher G
2708 - 2715 Molecular dynamics studies of the kinetics of freezing of (NaCl)(108) clusters
Huang JF, Zhu XL, Bartell LS
2716 - 2722 Ab initio investigation of reaction pathways for intramolecular charge transfer in dimethylanilino derivatives
Sobolewski AL, Sudholt W, Domcke W
2723 - 2731 Effect of structure and conformation on Raman trace scattering intensities in hydrocarbons
Gough KM, Dwyer JR
2732 - 2738 Ab initio study of the solvent effects on the singlet-triplet gap of nitrenium ions and carbenes
Gonzalez C, Restrepo-Cossio A, Marquez M, Wiberg KB, De Rosa M