Journal of Chemical Physics
15 Mar 1997, V106, N11.
%T An ab initio MO study on structures and energetics
of C{_3}H{^-}, C{_3}H, and C{_3}H{^+}
%A Shigeru Ikuta
%T Photoemission cross sections for CH radicals produced by collisions of
He(2{^3}S) atoms with CH{_3}X(X = H, Cl, Br, I)
%A Ikuo Tokue, Yuko Sakai, and Katsuyoshi Yamasaki
%T Pulsed discharge jet spectroscopy of DSiF and the
equilibrium molecular structure of monofluorosilylene
%A Warren W.Harper, David A.Hostetler, and Dennis J.Clouthier
%T Dynamics of OH and OD radical reactions with HI and GeH{_4} as studied
by infrared chemiluminescence of the H{_2}O and HDO products
%A N.I.Butkovskaya and D.W.Setser
%T Density functional study of structure and bonding in
lithium clusters Li{_n} and their oxides Li{_n}O
%A R.O.Jones, A.I.Lichtenstein, and J.Hutter
%T Scattering of fast N{_2} from Pd(111). A classical trajectory study
%A Thomas Schlatholter, Thorsten Schlatholter, Martin Vicanek,
and Werner Heiland
%T The electron affinity of hydrogen, deuterium, and tritium.
A non-adiabatic variational calculation using explicitly correlated
Gaussian basis functions
%A Donald B.Kinghorn and Ludwik Adamowicz
%T Vibrational state dependence of D{_2} dissociation on Ag(111)
%A C.Cottrell, R.N.Carter, A.Nesbitt, P.Samson, and A.Hodgson
%T Vibrational relaxation of clusters.Relation to potential surface
topography
%A Benjamin Vekhter, Keith D.Ball, John Rose, and R.Stephen Berry
%T Statistical modeling of collision-induced dissociation thresholds
%A M.T.Rodgers, Kent M.Ervin, and P.B.Armentrout
%T The intermolecular potential energy surface of the Ar{^.}NO{^+}
cationic complex
%A Andrew M.Bush, Timothy G.Wright, Vladimir Spirko, and Michael Jurek
%T Electron energy-loss rates in gaseous argon determined from transient
microwave conductivity
%A Hiroshi Shimamori and Takeyoshi Sunagawa
%T Comment on: The relation between unimolecular
reaction rates and overlapping resonances
%A I.Rotter
%T Reply to the Comment on: On the relation between
unimolecular reaction rates and overlapping resonances
%A Uri Peskin, Hanna Reisler, and William H.Miller
%T Absolute partial cross sections for electron-impact
ionization of CH{_4} from threshold to 1000 eV
%A H.C.Straub, D.lin, B.G.Lindsay, K.A.Smith, and R.F.Stebbings
%T Convergence of many-body perturbation methods
with lattice summations in extended systems
%A Jun-Qiang Sun and Rodney J.Bartlett
%T Ab initio study for chemical species in BC1{_3}
plasma. Structure, spectra, and decomposition paths
%A Kyoung K.Baeck and Rodney J.Bartlett
%T All-electron Dirac-Fock-Roothaan calculations on
the electronic structure of the GdF molecule
%A Hiroshi Tatewaki and Osamu Matsuoka
%T First observation and electronic spectroscopy of chromium mononitride.
The A {^4}{PI}{_r}<--X{^4}{SIGMA}{^-} transition near 745nm
%A Walter J.Balfour, Charles X.W.Qian, and Chi Zhou
%T Laser-induced fluorescence spectrum of the FCO radical
%A Bradley A.Williams and James W.Fleming
%T Multi-state vibronic coupling effects in the K-shell excitation spectrum
of ethylene. Symmetry breaking and core-hole localization
%A H.Koppel, F.X.Gadea, G.Klatt, J.Schirmer, and L.S.Cederbaum
%T Ab initio relativistic effective potentials
with spin-orbit operators. VII. Am through element 118
%A Clinton S.Nash, Bruce E.Bursten, and Walter C.Ermler
%T The splitting of excited electronic states in optically inactive
molecules due to the parity-violating electron-nuclear interaction
%A L.N.Ivanov and V.S.Letokhov
%T Comment on: Relaxation of collective excitations in LJ-13 cluster
%A David J.Wales and Jonathan P.K.Doye
%T Reply to Comment on: Relaxation of collective excitations in LJ-13
cluster
%A Umesh A.Salian, S.N.Behera, and V.S.Ramamurthy
%T A model study of quantum dot polarizability
calculations using time dependent density functional methods
%A Terese Bandy and Kenneth Haug
%T An instantaneous normal model description of relaxation in supercooled
liquids
%A T.Keyes, G.V.Vijayadamodar, and U.Zurcher
%T Vibrational spectroscopy of CH/NH stretches in pyrrole.
An algebraic approach
%A L.Lubich and S.Oss
%T Guided ion beam studies of the reactions of Fe{_n}{^+} (n = 2 - 18)
with O{_2}. Iron cluster oxide and dioxide bond energies
%A James B.Griffin and P.B.Armentrout
%T Jet spectroscopy of p-methoxyanline and IVR
dynamics in the p-alkoxyaniline series
%A S.Wategaonkar and S.Doraiswamy
%T The influence of a thin gold film on vibrational
excitation of hydrogen molecules
%A I.Cadez, R.I.Hall, M.Landau, F.Pichou, and C.Schermann
%T Photodissociation dynamics in the UV laser photolysis of DNCO.
Comparison with HNCO
%A R.A.Brownsword, M.Hillenkamp, T.Laurent R.K.Vatsa, and H.-R.Volpp
%T Application of symplectic integrator to stationary reactive-scattering
problems. Inhomogeneous Schrodinger equation approach
%A Kin'ya Takahashi and Kensuke S.Ikeda
%T Dynamical properties and transport coefficients of Kihara linear fluids
%A L.G.MacDowell, B.Garzon, S.Calero, and S.Lago
%T A method for accelerating the molecular dynamics
simulation of infrequent events
%A Arthur F.Voter
%T A molecular dynamics study of the CO{_2}/NaCl(001) system
%A Alessandro Vigiani, Gianni Cardini, and Vincenzo Schettino
%T Optical dephasing in pentacene-doped PMMA under high pressure
%A Otto Berg and Eric L.Chronister
%T Nucleation in superheated liquid argon - krypton solutions
%A V.G.Baidakov, A.M.Kaverin, and G.Sh.Boltachev
%T Diffusion influenced reversible transfer of electronic
excitation energy in liquid solution by long-range interaction
%A T.Bandyopadhyay
%T Far-infrared absorption spectra of water, ammonia, and
chloroform calculated from instantaneous normal mode theory
%A J.T.Kindt and C.A.Schmuttenmaer
%T A study of viscosity inhomogeneity in porous media
%A E.Akhmatskaya, B.D.Todd, P.J.Daivis, D.J.Evans, K.E.Buggins,
and L.A.Pozhar
%T Control of long-range electron transfer in dynamically disordered
molelcular systems by an external periodic field
%A I.A.Goychuk, E.G.Petrov, and V.May
%T Separating connectivity and expansion effects in
polymer single chain dynamics
%A David E.Kranbuehl and Peter H.Verdier
%T Kinetics of concurrent desorption and diffusion into the solid: D/Zr(0001)
%A M.Kovar, K.Griffiths, R.V.Kasza, J.G.Shapter, P.R.Norton, and V.P.Zhdanov
%T An effective transition state for a complex cluster isomerization process.
Comparison between anharmonic and harmonic models for Mg{^+}Ar{_12}
%A G.S.Fanourgakis, S.C.Farantos, P.Parneix, and Ph.Brechignac
%T On the scattering phenomena for various kinds of
polarized light in a nonpolar binary liquid mix-ture
%A Dong J.Lee and Kyoung-Ran Kim
%T Analysis of Rayleigh light scattering spectra
of pivalic acid in plastic and liquid phase
%A J.Kubicki, T.Wroz, and R.Naskrecki
%T Fluctuating Euler characteristics, topological
disorder line and passages in the lamellar phase
%A Robert Holyst and Wojciech T.Gozdz
%T Nonlinear electrical potential fluctuations of solvent around
solutes: An integral equation study
%A Song-Ho Chong and Fumio Hirata