Journal of Chemical Physics
1997, V106, N16, 22 Apr
%T Reaction dynamics of atomic hydrogen with the
hydrogenated Si(001) (2 x 1) surface
%A P.Kratzer
%T Fluorescence excitation and depletion spectroscopy
of the BAr complex.Electronic states correlating
with the excited valence B(2s2p{^2 2}D) asymptote
%A Xin Yang and Paul J.Dagdigian
%T A theoretical investigation of the spin-orbit
induced predissociation of BAr C{^2}{DELTA}
%A Karl Sohlberg and David R.Yarkony
%T Multireference configuration interaction study
of the mixed valence-Rydberg character of the
C{_2}H{_4} {^1}({pi,pi}{^*}) V state
%A Stefan Krebs and Robert J.Buenker
%T Raman spectra of ruthenium dimers
%A Huaiming Wang, Yifei Liu, Hanae Haouari,
R.Craig, John R.Lombardi, and D.M.Lindsay
%T Rovibrational and rotational autoionisation dynamics of Rydberg
electron wavepackets in H{_2}. A time-dependent MQDT approach
%A H.H.Fielding
%T Derivation of rotation-vibration Hamiltonians
that satisfy the Casimir condition
%A Kristy L.Mardis and Edwin L.Sibert
%T On the ab initio evaluation of Hubbard parameters. I. The
analytical approach in the absence of orbital relaxation
%A Alessandro Fortunelli and Anna Painelli
%T On the ab initio evaluation of Hubbard parameters.
II. The {_K }-(BEDT-TTF){_2} Cu[N(CN){_2}]Br crystal
%A Alessandro Fortunelli and Anna Painelli
%T Structure of the ammonium radical from a
rotationally resolved photoelectron spectrum
%A R.Signorell, H.Palm, and F.Merkt
%T Eigenstates for internal rotors with angle dependent moment of inertia
%A W.E.Mellor, T.M.Kalotas, and A.R.Lee
%T Determination of diabatic coupling potentials from
the inversion of laboratory inelastic scattering
data: Application to C{^4+} + He --> C{^2+} + He{^2+}
%A Robert Boyd, Tak-San Ho, and Herschel Rabitz
%T Photochemistry of dimethylcadmium on compound
semiconductor surfaces
%A P.J.Lasky, P.H.Lu, K.A.Khan, D.A.Slater, and R.M.Osgood, Jr.
%T Coupled cluster response functions revisited
%A Thomas Bondo Pedersen and Henrik Koch
%T {^19}F spin-rotation constants and shielding tensor
of sulphur difluoride from its microwave spectrum
%A Bethany Gatehouse, Holger S.P.Muller, and
Michael C.L.Gerry
%T Photoionization of C{_2}F{_4}/O{_2} complexes and C{_2}F{_4}
homoclusters
%A B.-M.Cheng, Jack M.Preses, and J.R.Grover
%T The photodissociation dynamics of OCl0 between 306
and 370 nm. Fragment translational energy release
and recoil anisotropy
%A Alan Furlan, Heiner A.Scheld, and J.Robert Huber
%T Photofragmentation study of Cl{_2} using ion imaging
%A Peter C.Samartzis, Ioannis Sakellariou, and Theofanis N.Kitsopoulos
%T Photodissociation dynamics of HCl in solid Ar.
Cage exit, nonadiabatic transitions and recombination
%A Anna I.Krylov and R.Benny Gerber
%T Bimodality in the dynamics response of a supercooled liquid
%A Sarika Bhattacharyya and Biman Bagchi
%T Application of free energy expansions to mesoscopic dynamics
of copolymer melts using a Gaussian chain molecular model
%A N.M.Maurits and J.G.E.M.Fraaije
%T Stochastic simulation of chemically activated unimolecular reactions
%A Luc Vereecken, Guido Huyberechts, and Jozef Peeters
%T Adsorption of rigid rodlike molecules
%A Akihiko Matsuyama, Reiko Kishimoto, and Tadaya Kato
%T Electron tunneling through water layers. Effect
of layer structure and thickness
%A Ilan Benjamin, Deborah Evans, and Abraham Nitzan
%T Ab initio statistical thermodynamical models for
the computation of third-law entropies
%A Allan L.L.East and Leo Radom
%T Statics and dynamics of dense copolymer melts.
A Monte Carlo simulation study
%A Alexander Hoffmann, Jens-Uwe Sommer, and Alexander Blumen
%T The hindered rotor density-of-states interpolation function
%A Richard B.McClurg, Richard C.Flagan,
and William A.Goddard, III
%T Photon correlation spectroscopy of interacting
and dissociating hemoglobin
%A Sabrina Beretta, Giuseppe Chirico, Daniele Arosio, and Giancarlo Baldini
%T The continuous configurational Boltzmann biased direct Monte Carlo
method for free energy properties of polymer chains
%A Jiro Sadanobu and William A.Goddard III
%T Phase diagrams of systems of particles interacting
via repulsive potentials
%A C.Rascon, E.Velasco, L.Mederos, and G.Navascues
%T Phase diagram of the hard biaxial ellipsoid fluid
%A Philip J.Camp and Michael P.Allen