Journal of Chemical Physics, 1999, V 111, N 12, 22 Sep.

TE Core to surface exchange and the melting of Ar{_12}-HF
   ({eta}=0). A J-walking-MD simulation
AU Madhavi Rajan Ghayal and E.Curotto

TE Singlet and triplet energies of {alpha}-oligothiophenes: A
   spectroscopic, theoretical and photoacoustic study.
   Extrapolation to polythiophene.
AU J.Seixas de Melo, Luis M.Silva, Luis G.Arnaut, and R.S.Becker

TE Photoelectron spectroscopy of the CH{_3}N{^-} ion
AU Michael J.Travers, Daniel C.Cowles, Eileen P.Clifford,
   G.Barney Ellison, and Paul Engelking

TE Eratum: Density function solvation model based on CM2 atomic
   charges [J. Chem. Phys. 109, 9117 (1998)]
AU Tianhai Zhu, Jiabo Li, Gregory D.Hawkins, Christopher J.Cramer,
   and Donald G.Truhlar

TE Erratum: A class IV charge model for molecular excited states
   [J. Chem. Phys. 110, 724 (1999)]
AU Jiabo Li, Brian Williams, Christopher J.Cramer,
   and Donald G.Truhlar

TE Infrared spectra of (NO){_2}{^-} and (NO){_2}{^+} isomers
   trapped in solid neon
AU Lester Andrews and Mingfei Zhou

TE Ultrafast predissociation and coherent phenomena in CS{_2}
   excited by femtosecond laser pulses at 194...207nm
AU P.Farmanara, V.Stert, and W.Radloff

TE Cross section and asymmetry parameter calculation for sulphur 1s
   photoionization of SF{_6}
AU Alexandra P.P.Natalense and Robert R.Lucchese

TE Wavepacket motion during thermalization of relaxed excited state
   in one-dimensional platinum dimethyllyoxime complex
AU Shinichiro Iwai, Toshihide Kamata, Shigeo Murata,
   Kaoru Yamamoto, and Toshiaki Ohta

TE Effect of solvent density and species on static and dynamic
   fluorescence Stokes shifts of coumarin 153
AU Y.Kimura and N.Hirota

TE Calculated and experimental rotational constants of
   (D{_2}O){_3}: Effects of intermolecular torsional and symetric
   stretching excitations
AU Dubravko Sabo, Zlatko Bacic, Stephan Graf, and Samuel Leutwyler

TE Prediction of electron paramagnetic resonance G-tensors of
   transition metal complexes using density functional theory:
   First applications to some axial d{^1} MEX{_4} systems
AU S.Patchkovskii and T.Ziegler

TE A direct procedure for the evaluation of solvent effects in
   MC-SCF calculations
AU Maurizio Cossi, Vincenzo Barone, and Michael A.Robb

TE Long-range effects in optimizing the geometry of stereoregular
   polymers. I. Formalism
AU Denis Jacquemin, Jean-Marie Andre, and Benoit Champagne

TE Long-range effects in optimizing the geometry of stereoregular
   polymers. II. Hydrogen fluoride chains as a working example
AU Denis Jacquemin, Jean-Marie Andre, and Benoit Champagne

TE Molecular dynamics study of vibrational energy relaxation of
   CN{^-} in H{_2}O and D{_2}O solutions: An application of path
   integral influence funcional theory to multiphonon processes
AU Motoyuki Shiga and Susumu Okazaki

TE Electron transfer in a slow relaxation bath: Fast and slow
   degrees of freedom. Application to priary electron transfer in
   photosynthetic bacteria
AU Yuri Dakhnovskii

TE The alanine dipeptide free energy surface in solution
AU Paul E.Smith

TE A Monte-Carlo simulation and symmetric Poissonolzmann study of a
   four-component electrolyte mixture
AU J.Rescic, V.Vlachy, C.W.Outhwaite, L.B.Bhuiyan, and A.K.Mukherjee

TE Crossover behavior in dilute polymer solutions: Square-well
   chains
AU L.Lue and S.B.Kiselev

TE Instantaneous normal mode theory of diffusion and the potential
   energy landscape: Application to supercooled liquid CS{_2}
AU Wu-Xiong Li and T.Keyes

TE A new and more direct test of Hubbard relations from molecular
   mass distribution influence on linear liquid dynamics
AU S.Calero, S.Lago, and B.Garzon

TE Feynman path centroid dynamics for Fermi-Dirac statistics
AU Pierre-Nicholas Roy, Seogjoo Jang, and Gregory A.Voth

TE The effect of a strong external field on the elecronic dephasing
   of a solute that is strongly coupled to a solvent
AU R.I.Cukier, C.Denk, and M.Morillo