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