Journal of Chemical Physics, 1998, V 108, N13, 1 Apr.
TE Valence states of C_{2} Feynman's way
AU Thomas E.Sorensen and Walter B.England
TE Relativistic and correlation effects on molecular properties.
The interhalogens ClF, BrF, BrCl, IF, ICl and IBr
AU W.A.de Jong, J.Styszynski, L.Visscherm, and W.C.Nieuwpoort
TE On the time-dependent Lagrangian approach in quantum chemistry
AU Thomas Bondo Pedersen and Henrik Koch
TE Kinetic oscillations in the catalytic CO oxidation
on Pt single crystal surfaces. Theory and simulation
AU V.N.Kuzovkov, O.Kortluke, and W.von Niessen
TE Analytical energy gradients for local second-order
Moller-Plesset perturbation theory
AU Adel El Azhary, Guntram Rauhut, Peter Pulay,
and Hans-Joachim Werner
TE Effects of local reactant concentration perturbations
in oscillatory catalysis
AU C.D.Lund, C.M.Surko, M.B.Maple, and S.Y.Yamamoto
TE Extracting site-specific reaction rates from
steady state surface morphologies. Kinetic
Monte Carlo simulations of aqueous Si(111) etching
AU Jaroslav Flidr, Yi-Chiau Huang, Theresa A.Newton,
and Melissa A.Hines
TE Potential energy surfaces of NaFH
AU Maria S.Topalar, Donald G.Truhlar, Xiao Yan Chang, Piotr Piecuch,
and John C.Polany
TE The photoadsorption spectrum of Na...FH van der Waals molecule.
Comparison of theory and experiment for a harpooning reaction
studied by transition state spectroscopy
AU Maria S.Topaler, Donald G.Truhlar, Xiao Yang Chang,
Piotr Piecuch, and John C.Polanyi
TE Quasiclassical trajectory simulations of collisional vibrationally
excited HgBr(B^{2}{SIGMA}). II. Dependence on rotational excitation
AU G.F.Velardez, R.A.Bollati, and J.C.Ferrero
TE Classical trajectory and adiabatic channel study of the dynamics
of capture and unimolecular bond fission.
IV. Valence interactions between atoms and linear rotors
AU A.I.Maergoiz, E.E.Nikitin, J.Troe, and V.G.Ushakov
TE Theoretical investigations on the reactions NH + HO_{2} and
NH_{2} + O_{2}. Electronic structure calculations
and kinetic analysis
AU R.Sumathi and S.D.Peyerimhoff
TE Linear and non-linear optical properties of platinum-ethynyl
AU T.J.McKay, J.A.Bolger, J.Staromlynska, and J.R.Davy
TE Temperature and pressure dependence of the addition
reactions of HO to NO and to NO_{2}. IV. Saturated
laser induced fluorescence measurements up to 1400 bar
AU D.Fulle, H.F.Hamann, H.Hippler, and J.Troe
TE Mass-resolved VUV laser spectroscopy of XeAr.
Two competing predissociation pathways in the C1 state
AU Shilin Liu, Akiyoshi Hishikawa, and Kaoru Yamanouchi
TE Anharmonicity and cross-section for absorption
of radiation by water dimer
AU H.C.W.Tso, D.J.W.Geldart, and Petr Chylek
TE Two-dimensional scattering of slow molecules by laser beams
AU Tamar Seideman and V.Kharchenko
TE A photoelectron spectroscopic study of
monovanadium oxide anions (VO_{x}^{-}, x=1-4)
AU Hongbin Wu and Lai-Sheng Wang
TE Effect of charge upon metal cluster chemistry. Reactions of
Nb_{n} and Rh_{n} anions and cations with benzene
AU Christian Berg, Martin Beyer, Uwe Achatz, Stefan Joos,
Gereon Niedner-Schatteburg, and Vladimir E.Bondybey
TE Reactivity of niobium clusters with nitrogen and deuterium
AU A.Berces, P.A.Hackett, Li Lian, S.A.Mitchell, and D.M.Rayner
TE The unimolecular dissociation of H_{2}CO on the
lowest triplet potential energy surface
AU Yukio Yamaguchi, Steven S.Wesolowski,Timothy J.Van Huis,
and Henry F.Schaefer III
TE Germyne, H-C=Ge-H, and the excited states of
1. Germavinylidene, H_{2}C=Ge
AU Steven M.Stogner and Roger S.Grev
TE Primary and secondary processes in the 193 nm
photodissociation of vinyl chloride
AU David A.Blank, Weizhong Sun, Arthur G.Suits, Yuan T.Lee,
Simon W.North, and Gregory E.Hall
TE Pressure induced change of the stereo-chemical
activity of a lone electron pair
AU Bjorn Winkler, Victor Milman, and Ming-Hsien Lee
TE Collisional intrashell transitions in alkaly
Rydberg atoms under zero-electron-kinetic-energy conditions
AU Paolo Bellomo, David Farrelly, and T.Uzer
TE Time-dependent quantum mechanical calculations on
H + O_{2} for total angular momentum J > O
AU Anthony J.H.M.Meijer and Evelyn M.Goldfield
TE Relativistic effects in silicon chemistry. Are the experimental
heats of formation of the silicon atom and SiH_{4} compatible?
AU Charlene L.Collins and Roger S.Grev
TE Infrared hole burning of ammonium tartrate.
How high a barrier can be overcome?
AU Zhan Chen and Herbert L.Strauss
TE Exciton-migration and three-pulse femtosecond optical
spectroscopy of photosynthetic antenna complexes
AU Wei Min Zhang, Torsten Meier, Vladimir Chernyak, and Shaul Mukamel
TE Dipole polarizabilities of the potassum atom in its ground
(4 ^{2}S) and excited (4 ^{2}P, 5 ^{2}S) states,
and long-range dispersion interactions between two K atoms
AU Mohammadou Merawa and Didier Begue
TE Molecular similarity based on information entropies and distances
AU Minhhuy Ho, Vedene H.Smith, Jr. Donald F.Weaver, Carlo Gatti,
Robin P.Sagar, and Rodolfo O.Esquivel
TE Electronic structure of benzene adsorbed on single-domain
Si(001)-(2x1). A combined experimental and theoretical study
AU S.Gokhale, P.Trischberger, D.Menzel, W.Widdra, H.Droge,
H.-P.Steinruck, U.Birkenheuer, U.Gutdeutsch, and N.Rosch
TE Nearside-farside analysis of differential cross sections.
Ar + N_{2} rotationally inelastic scattering using associated
Legendre functions of the first and second kinds
AU P.McCabe, J.N.L.Connor, and D.Sokolovski
TE The polymerization of actin. Study by small angle neutron
scattering
AU Robert Ivkov, Jeffrey G.Forbes, and Sandra C.Greer
TE Diamond lattice model of semicrystalline
polyethylene in the amorphous region
AU Zhong-Hui Duan and Louis N.Howard
TE Step growth of an AB_{2} monomer, with cycle formation
AU Colin Cameron, Allan H.Fawcett, Cecil R.Hetherington,
Richard A.W.Mee, and Frederick V.McBride
TE A stochastic technique for solving the Lorentz-Boltzmann equation
for hard spheres. Application to the kinetics of gas absorption
AU C.P.Lowe and A.J.Masters
TE Reversible work of formation of an embryo of
a new phase within a uniform macroscopic mother phase
AU Pablo G.Debenedetti and Howard Reiss
TE Escape through a bottleneck undergoing non-Markovian fluctuations
AU D.J.Bicout and Attila Szabo
TE Renormalization-group corrections to an approximate free-energy
model for simple fluids
AU Leo Lue and John M.Prausnitz
TE Orientation of the quadrupole and dipole tensors of hydroxyl
groups by ^{17}O quadrupole separated local field NMR
AU E.R.H.van Eck and M.E.Smith