Journal of Chemical Physics
1997, V106, N13, 01 Apr
%T Laser-induced fluorescence spectroscopy of the
C{^~ 2}{SIGMA}{^+}-X{^~ 2}{PI}{_1/2} band system
of the jet-cooled CCN radical
%A Hiroshi Kohguchi, Yasuhiro Ohshima, and Yasuki Endo
%T Quantum-mechanical wavepacket calculation of photoinduced
surface reaction. O{_2}/Pt(111)
%A Johan Stromquist and Shiwu Gao
%T Photodissociation of Kr{_2}F (4{^2}{GAMMA}) in the ultraviolet
and near-infrared. Wavelength dependence of KrF
(B{^2}{SIGMA}) yield
%A J.H.Schloss, H.C.Tran, and J.G.Eden
%T The dissociative recombination of hydrocarbon ions. I. Light alkanes
%A L.Lehfaoui, C.Rebrion-Rose, S.Laube, J.B.A.Mitchell, and B.R.Rowe
%T Kinematic mass model of activated bimolecular reactions.
Molecular shape effects and zero-point energy corrections
%A Marko Perdih, Adolf Miklavc, and Ian W.M.Smith
%T Excited state kinetics of neutral transition
metal atoms by stimulated emission pumping.
V{^*}(3d{^4}4s, a{^4}D) + hydrocarbons
%A Ye Wen, Arun Yethiraj, and James C.Weisshaar
%T Two-dimensional deuterium magic-angle-spinning
NMR of paramagnetic compounds. Separation of
paramagnetic and quadrupole interactions
%A Thomas P.Spaniol, Atsushi Kubo, and Takehiko Terao
%T Linear scaling computation of the Fock matrix
%A Matt Challacombe and Eric Schwegler
%T Degenerate four wave mixing spectroscopy and spectral simulation
of C{_2} in an atomospheric pressure oxy-acetylene flame
%A C.F.Kaminski, I.G.Hughes, and P.Ewart
%T Classical and approximate quantum investigations of
vibrational energy transfer in S{_1} p-difluoro-benzene
%A Meredith J.T.Jordan and David C.Clary
%T Photochemistry and dynamics of C{_6}H{_6}-O{_2} clusters at 226 nm
%A Gary DeBoer and Mark A.Young
%T Calculation of electronic tunneling matrix element
in proteins. Comparisons of exact and approixmate
one-electron methods for Ru-modified azurin
%A Iraj Daizadeh, John N.Gehlen, and Alexei A.Stuchebrukhov
%T Theoretical studies of large water clusters.
(H{_2}O){_28}, (H{_2}O){_29}, (H{_2}O){_30} and
(H{_2}O){_31} hexa-kaidecahedral structures
%A Arshad Khan
%T Second-order density-functional description of
molecules and chemical changes
%A Shubin Liu and Robert G.Parr
%T Coupled-cluster calculations of the excitation
energies of benzene and the azabenzenes
%A Janet E.Del Bene, John D.Watts, and Rodney J.Bartlett
%T Linear scaling conjugate gradient density matrix
search as an alternative to diagonalization for
first principles electronic structure calculations
%A John M.Millam and Gustavo E.Scuseria
%T Vibrational relaxation of multiphonon bound
states in crystalline HC1
%A Cristina Gellini, Pier Remigio Salvi, and Vincenzo Schettino
%T Vibrational excitation of methane by 15 and 30 eV
intermediate-energy electron impact
%A F.Motte-Tollet, J.Heinesch, J.M.Gingell, and N.J.Mason
%T Ab-initio pseudopotential calculation of the
photo-response of metal clusters
%A J.M.Pacheco and Jose Luis Martins
%T Fragment rotational distributions from the dissociation
of NeBr{_2}. Experimental and classical traectory studies
%A Mehdi Nejad-Sattari and Thomas A.Stephenson
%T Laser probing of velocity-subgroup dependent
rotational alignment of N{_2}{^+} drifted in He
%A Eric B.Anthony, Wolfgang Schade, Michael J.Bastian,
Veronica M.Bierbaum, and Stephen R.Leone
%T Rotational spectra, structure, and internal
dynamics of Ar-H{_2}S isotopomers
%A H.S.Gutowsky, T.Emilsson, and E.Arunan
%T The weak interaction potential of Ar-H{_2}S
%A Glenisson de Oliveira and Clifford E.Dykstra
%T The electron affinity of iridium
%A B.J.Davies, C.W.Ingram, D.J.Larson, and U.Ljungblad
%T Surface scattering of hyperthermal (10-50 eV)
neutral C{_60}. Angular and energy distributions
%A A.Budrevich, B.Tsipinyuk, A.Bekkerman, and E.Kolodney
%T Quantum interference in resonant Raman spectra
of I{_2} in condensed media
%A M.Ovchinnikov and V.A.Apkarian
%T Rotationally resolved energy-dispersive photo-electron spectroscopy
of H{_2}O: Photoionization of the C{^~}(O,O,O) state at 355 nm
%A W.L.Glab, P.T.Glynn, P.M.Dehmer, J.L.Dehmer, Kwanghsi Wang, and
B.V.McKoy
%T Viscoelastic effects in early stage phase separation in polymeric systems
%A Akira Onuki and Takashi Taniguchi
%T Solvation forces between rough surfaces
%A Laura J.Douglas Frink and Frank van Swol
%T The self-consistent statistical theory of condensation
%A A.G.Vompe and G.A.Martynov
%T A molecular dynamics study of impurity desorption
from solid clusters of rigid C{_60} molecules
%A M.C.Abramo and C.Caccamo
%T Molecular dynamics study of a lipid bilayer.
Convergence, structure, and long-time dynamics
%A Wataru Shinoda, Nobuo Namiki, and Susumu Okazaki
%T Thermal conductivity of an organic clathrate.
Possible generality of glass-like thermal
conductivity in crystalline molecular solids
%A Darek Michalski and Mary Anne White
%T Modified nonequilibrium molecular dynamics
for fluid flows with energy conservation
%A Mark E.Tuckerman, Christopher J.Mundy,
Sundaram Balasubramanian, and Michael L.Klein
%T Ionic mobility in alcohols. From dielectric
friction to the solvent-berg model
%A Ranjit Biswas and Biman Bagchi
%T A Knudsen effusion mass spectrometric study of the molecule Si{_3}N
%A Karl A.Gingerich, R.Viswanathan, and Richard W.Schmude, Jr.
%T Electrostriction effects on electron transfer
reactions in solution. I.Adiabatic regime
%A Jonggu Jeon and Hyung J.Kim
%T Conformational properties of flexible polymer chains
in highly confined environments
%A Sonia Jorge and Antonio Rey
%T Tricritical behavior of an off-lattice flexible polymer
model. Monte Carlo calculation of second virial coefficients
%A Ana M.Rubio and Juan J.Freire
%T New statistical mechanical treatment of systems
near surfaces. I. Theory and principles
%A P.D.Gujrati and Mukeshj Chhajer
%T Integral equation theory of solutions of rigid polyelectrolytes
%A Chwen-Yang Shew and Arun Yethiraj
%T The reactive flux method applied to complex isomerisation
reactions. Using the unstable normal mode as a reaction coordinate
%A W.K.den Otter and W.J.Briels