Journal of Chemical Physics, 1998, V 108, N 23, 15 Jun.
TE Direct reaction of gas-phase atomic hydrogen with
chemisorbed chlorine atoms on a silicon surface
AU Y.H.Kim, J.Ree, and H.K.Shin
TE Experimental and ab initio study of the infrared spectra of ionic
species derived from SF_{6} and SF_{4} and trapped in solid neon
AU Catherine L.Lugez, Marilyn E.Jacox, Rollin A.King
and H.F.Schaefer III
TE Supercollision energy dependence. State-resolved energy transfer
in collisions between highly vibrationally excited pyrazine
(E_{vib} = 37,900 cm^{-1} and 40,900 cm^{-1}) and CO_{2}
AU Mark C.Wall and Amy S.Mullin
TE Ab initio study for the low lying electronic states of Al_{3}
and Al_{3}^{-}. The photoelectron spectroscopy of Al_{3}^{-}
AU Kyoung K.Baeck and Rodney J.Bartlett
TE Dynamics of vibronically excited fluorene-Ar_{n} (n=4,5) clusters
AU Jonathan D.Pitts and J.L.Knee
TE Optimized density functionals from the extended G2 test set
AU Hartmut L.Schmider and Axel D.Becke
TE State-to-state differential cross sections for the reaction
F+D_{2} at 90 meV. A crossed molecular beam experiment and a
quantum mechanical study
AU M.Baer, M.Faubel, B Martinez-Haya, L.Y.Rusin, U.Tappe,
and J.P.Toennies
TE Vibronic structure in the multiple state fluorescence spectrum of
C_{70}. A theoretical investigation
AU Fabrizia Negri and Giorgio Orlandi
TE Theoretical study of the O-H stretching band in
3-hydroxy-2-methyl-4-pyrone
AU V.Alexandrov, D.M.A.Smith, H.Rostkowska, M.J.Nowak, L.Adamowicz,
and W.McCarthy
TE Photoionization spectroscopy of dichromium and dimolybdenum.
Ionization potentials and bond energies
AU Benoit Simard, Marie-Ange Lebeault Dorget, Adrian Marijnissen,
and J.J.ter Meulen
TE Transient nucleation on inhomogeneous foreign substrate
AU Z.Kozisek, P.Demo, and M.Nesladek
TE Quantum transition state theory. Perturbation expansion
AU Jiushu Shao, Jie-Lou Liao, and Eli Pollak
TE Semiclassical approximations for the calculation of thermal rate
constants for chemical reactions in complex molecular systems
AU Haobin Wang, Xiong Sun, and William H.Miller
TE First spectroscopic evidence for molecular HCl on a liquid surface
with sum frequency generation
AU Steve Baldelli, Cheryl Schnitzer, and Mary Jane Shultz
TE Density functional investigation of the geometric and electronic
strucutre of ethylene adsorbed on Si(001)
AU U.Birkenheuer, U.Gutdeutsch, N.Rosch, A.Fink, S.Gokhale, D.Menzel,
P.Trischberger, and W.Widdra
TE Reactions of oxygen atoms with van der Waals complexes. The effect
of complex formation on the internal energy distribution in the
products
AU A.B.McCoy, M.W.Lufaso, M.Veneziani, S.Atrill, and R.Naaman
TE High level ab initio molecular orbital study of the structures
and vibrational spectra of CHBr^{+} and CBr^{+}
AU Z.Li and J.S.Francisco
TE Photo-induced nucleation in supersaturated mercury vapor
AU H.Uchtmann, R.Dettmer, S.D.Baranovskii, and F.Hensel
TE Solute-solvent pair distribution functions in highly asymmetric
additive hard sphere mixtures
AU Douglas Henderson and Kwong-Yu Chan
TE Brillouin spectra and vibrational-translational
energy exchange in liquid acetonitrile
AU Paola Sassi, Giulio Paliani, and Rosario Sergio Cataliotti
TE Critical depletion of fluids in pores. Competing bulk and surface
fields
AU A.Maciolek, A.Ciach, and R.Evans
TE Subglass chain dynamics and relaxation in polyethylene.
A molecular dynamics simulation study
AU Yong Jin and Richard H.Boyd
TE Cu^{+}^{+} and Li^{+} interaction with polyethylene oxide by
ab-initio molecular dynamics
AU Amedeo Palma, Alfredo Pasquarello, Giovanni Ciccotti,
and Roberto Car
TE A molecular dynamics simulation of water confined
in a cylindrical SiO_{2} pore
AU M.Rovere, M.A.Ricci, D.Vellati, and F.Bruni
TE Correcting for electrostatic cutoffs in free energy simulations.
Toward consistency between simulations with different cutoffs.
AU Haluk Resat and J.Andrew McCammon
TE Interfacial properties of water in an extended van-der-Waals theory
AU Lothar Muehlbacher
TE Random sequential adsorption on partially covered surfaces
AU Zbigniew Adamczyk and Pawel Weronski
TE Linear viscoelasticity of colloidal mixtures
AU G.Naegele and J.Bergenholtz
TE Numerical self-consistent field study of tethered
chains in O solvent
AU R.Baranowski and M.D.Whitmore
TE Nuclear magnetic and quadrupole resonance study of molecular
dynamics in a model bilayer compound C_{6}H_{13}NH_{3}Cl
AU J.Seliger and V.Zagar
TE Differential scanning calorimetry, x-ray diffraction and ^{19}F
nuclear magnetic resonance investigations of the crystallization
of InF_{3}-based glasses
AU R.W.A.Franco, C.C.Tambelli, C.J.Magon, J.P.Donoso, and M.Poulain