Journal of Chemical Physics, 1998, V108, N11, 15 Mar.


TE Vibrational frequencies of the 2p {^2}A"{_2} and
   3d {^2}E" states of the triatomic deuterium molecule
AU U.Muller, M Braun, R.Reichle, and R.F.Salzgeber
$$
TE The C-Cl bond fissions from the photolysis of CHCl=CCl{_2} at 193 nm
AU Yu-Jinn Lee, Ya-Rong Lee, Chih-Chiang Chou, and Shen-Maw Lin
$$
TE Non-iterative energy corrections through fifth-order
   to the coupled cluster singles and doubles method
AU Stanislaw A.Kucharski and Rodney J.Bartlett
$$
TE Sixth-order energy corrections for converged coupled
   cluster singles and doubles amplitudes
AU Stanislaw A.Kucharski and Rodney J.Bartlett
$$
TE Determination of alkyl chain tilt angles in Langmuir monolayers.
   A comparison of Brewster angle autocorrelation spectroscopy and
   X-ray diffraction
AU C.Lautz, Th.M.Fischer, M.Weygand, M.Losche, P.B.Howes, and K.Kjaer
$$
TE Spin-orbit branching in the photofragmentation of
   HCl at long wavelength
AU H.Mark Lambert, Paul J.Dagdigian, and Millard H.Alexander
$$
TE The description of the multiquantum effects in electron paramagnetic
   resonance spectroscopy using the Bloch equation
AU Malgorzata Jelen and Wojciech Froncisz
$$
TE Magnetic field control of an electron tunnel current through
   a molecular wire
AU E.G.Petrov, I.S.Tolokh, and V.May
$$
TE Geometries and energy separations of the
   electronic states of Ge{_5}{^+} and Sn{_5}{^+}
AU Dingguo Dai and K.Balasubramanian
$$
TE Molecular bending mode frequencies of the surface
   and interior of crystalline ice
AU Justin Hernandez, Nevin Uras, and J.Paul Devlin
$$
TE Static structure factor and electron correlation
   effects studied by inelastic x-ray scattering spectroscopy
AU Noboru Watanabe, Hisashi Hayashi, Yasuo Udagawa, Seiichiro Ten-no,
   and Suehiro Iwata
$$
TE Torsional splitting of the intermolecular vibrations of
   phenol(H{_2}O){_1} and its deuterated isotopomers
AU M.Schmitt, Ch.Jacoby, and K.Kleinermanns
$$
TE Rotational analysis and tunnel splittings of the intermolecular
   vibrations of the phenol-water complex by high resolution UV
   spectroscopy
AU R.M.Helm, H.-P.Vogel, and H.J.Neusser
$$
TE Multicenter integrals of spherical Laguerre Gaussian orbitals by
   generalized spherical gradient operators
AU Lue-yung Chow Chiu and Mohammad Moharerrzadeh
$$
TE Molecular excitation energies to high-lying bound states from
   time-dependent density-functional response theory.Characterization
   and correction of the time-dependent local density approximation
   ionization threshold
AU Mark E.Casida, Christine Jamorski, Kim C.Casida,
   and Dennis R.Salahub
$$
TE The 5f{pi} {^3}{PI}{_g} <-- a {^3}{SIGMA}{^+}{_u} and 5f{sigma}
   {^3}{SIGMA}{^+}{_g} <-- a {^3}{SIGMA}{^+}{_u} systems of Ar{_2}
AU C.M.Herring, J.G.Eden, and M.L.Ginter
$$
TE Accurate universal Gaussian basis set for all atoms of the periodic
   table
AU E.V.R.de Castro and F.E.Jorge
$$
TE Diels-Alder reactions of butadienes with the Si(100)-2x1 surface as
   a dienophile. Vibrational spectroscopy, thermal desorption and
   near edge X-ray absorption fine structure studies
AU Andrew V.Teplyakov, Maynard J.Kong, and Stacey F.Bent
$$
TE Relaxation of nitrobenzene from the excited singlet state
AU M.Takezaki, N.Hirota, and M.Terazima
$$
TE Isotope exchange reaction between {^235}UF{_5} nano-particles
   and {^238}UF{_6} gas
AU Yoshikazu Kuga and Kazuo Takeuchi
$$
TE Theoretical investigation of weakly-bound complexes of
   O({^3}P) with H{_2}
AU Millard H.Alexander
$$
TE Electron transfer driven by conformational variations
AU Michal Pudlak
$$
TE Atomic orbitals in molecules
AU Jerzy Cioslowski and Andrew Liashenko
$$
TE Hydrogen bonding described through diatomics-in-ionic-systems.
   The HF dimer
AU B.L.Grigorenko, A.V.Nemukhin, and V.A.Apkarian
$$
TE The adiabatic rotation approximation for rovibrational energies
   of many-mode systems. Description and test of the method
AU Stuart Carter and Joel M.Bowman
$$
TE Fractal kinetics and surface reactions
AU F.Moiny, Martine Dumont, and R.Dagonnier
$$
TE Integral equations and simulation studies of water like models
AU Fernando Bresme
$$
TE Critical properties of the self-consistent Ornstein-Zernike
   approximation for 3-dimensional lattice gases with varying
   range of interaction
AU A.Borge and J.S.Hoye
$$
TE Impulsive stimulated scattering in ice VI and ice VII
AU Bruce J.Baer, J.M.Brown, Joseph M.Zaug, Dave Schiferl,
   and Eric L.Chronister
$$
TE Structural transitions in metal ion-doped noble gas clusters.
   Experiments and molecular dynamics simulations
AU Dimitris Prekas, Christian Lueder, and Michalis Velegrakis
$$
TE Surface roughening. Kinetics, adsorbate-induced effects,
   and manifestations in catalytic reactions
AU V.P.Zhdanov and B.Kasemo
$$
TE Orthogonal polynomial approach to fluids with internal degrees
   of freedom. The case of polar, polarizable molecules
AU F.Lado, E.Lomba, and M.Lombardero
$$
TE Simulation of phase equilibria for polymer-super-critical
   solvent mixtures
AU Dmitry G.Gromov, Juan J.de Pablo, Gabriel Luna-Barcenas,
   Isaac C.Sanchez, and Keith P.Johnston
$$
TE Free-volume distribution and positronium formation in amorphous
   polymers. Temperature and positron-irradiation-time dependence
AU C.L.Wang, T.Hirade, F.H.J.Maurer, M.Eldrup, and N.J.Pedersen
$$
TE Broadband dielectric study of anomalous diffusion in a
   poly(propylene glycol) melt confined to nanopores
AU A.Schoenhals and R.Stauga
$$
TE Elastic properties of homopolymer-homopolymer
   interfaces containing diblock copolymers
AU Mohamed Laradji and Rashmi C.Desai
$$
TE Monte Carlo simulations of symmetric polymer
   blends 1. Characterization of the interface
AU Oskar Friedrich Olaj, Thomas Petrik, and Gerhard Zifferer
$$
TE Effect of composition fluctuations on tracer
   diffusion in symmetric diblock copolymers
AU Rangaramanujam M.Kannan, Jie Su, and Timothy P.Lodge
$$
TE Contribution of the center of mass fluctuation of a
   liquid cluster to the free energy. A Monte Carlo simulation study
AU K.J.Oh and X.C.Zeng
$$