TE On the application of canonical perturbation theory to floppy molecules AU Dominique Sugny and Marc Joyeux TE A combined reaction class approach with integrated molecular orbital + molecular orbital (IMOMO) mehodology: A practical tool for kinetic modeling AU Thanh N.Truong, Dilip K.Maity, and Thanh-Thai T.Truong TE Autoionization-detected infrared spectroscopy of intramolecular hydrogen bonds in aromatic cations. II. Unconventional intramolecular hydrogen bonds AU Eiji Fujimaki, Asuka Fujii, Takayuki Ebata, and Naohiko Mikami TE Collisional effects on spectral line shape from the Doppler to the collisional regime: A rigorous test of a unified model AU F.Chaussard, X.Michaut, R.Saint-Loup, H.Berger, P.Joubert, B.Lance, J.Bonamy, and D.Robert TE Effects of reagent rotation and the accuracy of the centrifugal sudden approximation in the H{_2} + CN reaction AU Dong H.Zhang and Soo-Y.Lee TE Combined iterative diagonalisation and statistical sampling in accurate reaction rate calculations: Rotational effects in O + HCl --> OH + Cl AU Frank Matzkies and Uwe Manthe TE Photodissociation of hydrogen halides in rare gas matrices and the effect of hydrogen bonding AU Martin Lorenz, Dieter Kraus, Markku Rasanen, and Vladimir E.Bondybey TE The rotational spectrum of single OCS molecules in liquid {^4}He droplets AU Slava Grebenev, Matthias Hartmann, Martina Havenith, Boris Sartakov, J.Peter Toennies, and Andrei F.Vilesov TE Saddle-node bifurcations in the spectrum of HOCl AU J.Wei{beta}, J.Hauschildt, S.Yu.Grebenshchikov, R.Duren, R.Schinke, J.Koput, S.Stamatiadis, and S.C.Farantos TE Laser driven ground state photodissociation of HCo(CO){_4}: An ab initio quantum molecular dyamics approach AU Ann E.Orel, Yi Zhao, and Oliver Kuhn TE Charge transfer and chemical reaction dynamics in hyperthermal O{^+} + NO collisions AU Dale J.Levandier, Yu-hui Chiu, and Rainer A.Dressler TE Molecular parameters for {^12}C and {^13}C-methanol isotopomers with O-16, 17 and 18 AU Yun-Bo Duan, Anne B.McCoy, Li Wang, and Kojiro Takagi TE Quantum dynamics of the O({^3}P)+CH{_4} --> OH+CH{_3} reaction: An application of the rotating bond umbrella model and spectral transform subspace iteration AU Hua-Gen Yu and Gunnar Nyman TE Forward-backward initial value representation for the calculation of thermal rate constants for rections in complex molecular systems AU Haobin Wang, Michael Thoss, and William H.Miller TE Erratum: Cross section and asymmetry parameter calculation for sulfur 1s photoionization of SF{_6} [J. Chem. Phys. 111, 5344 (1999)] AU Alexandra P.P.Natalense and Robert R.Lucchese TE Charge transfer to solvent (CTTS) energies of small X{^-}(H{_2}O){_n=1-4} (X=F,Cl,Br,I) clusters: Ab initio study AU D.Majumdar, Jongseob Kim, and Kwang S.Kim TE Global ab initio potential energy surfaces for the ClH{_2} reactive system AU Wensheng Bian and Hans-Joachim Werner TE Nonadditive three-body polarizabilities of moleules interacting at long range: Theory and nuerical results for the inert gases, H{_2},N{_2}, CO{_2}, and CH{_4} AU M.H.Champagne, X.Li, and K.L.C.Hunt TE Nuclear magnetic shielding in the acetylene isoopomers calculated from correlated shielding surfaces AU Richard D.Wigglesworth, William T.Raynes, Sheela Kirpekar, Jens Oddershede, and Stephen P.A.Sauer TE Energy gradients and effective density differences in electron propagator theory AU J.V.Ortiz TE Electronic structure of polyglycine as a function of proton position AU I.A.Howard and M.Springborg TE A fast ab initio model for the calculation of exited electronic states of atoms and molecules in a weakly polarizable environment. I. Theory AU Christian F.Kunz and Bernd A.He{beta} TE A fast ab initio model for the calculation of exited states of atoms and molecules in a weakly polarizable environment. II. Application to the spectrum of cessium in liquid helium AU Christian F.Kunz and Bernd A.He{beta} TE Ab initio study of (NH{_3}){_2}: Accurate structure and energetics AU Jae Shin Lee and Sun Yong Park TE Perturbation theory of three-body exchange nondditivity and application to helium trimer AU Victor F.Lotrich and Krzysztof Szalewicz TE Application of time-dependent density-functional theory to the {^3}{SIGMA}{_u}{^-} first excited state of H{_2} AU Zheng-Li Cai and Jeffrey R.Reimers TE Experimental and theoretical anharmonicity for benzene using density functional theory AU Andrea Miani, Elisabetta Cane, Paolo Palmieri, Agostino Trombetti, and Nicholas C.Handy TE Ab initio configuration interaction study of the predissociation of the (4s), (4p{sigma}) {^1,3}{PI} and (4p{pi}) {^3}{SIGMA}{^+} Rydberg states of HCl and DCl AU Yan Li, Ota Bludsky, Gerhard Hirsch, and Robert J.Buenker TE The Hartree product and the description of local and global quantities in atomic systems: A study within Kohn-Sham theory AU Jorge Garza, Jeffrey A.Nichols, and David A.Dixon TE Supercooling and transient phase induced nucleation in n-alkane solutions AU E.B.Sirota TE Molecular dynamics simiulations with constrained roto-translational motions: Theoretical basis and statistical mechanical consistency AU A.Amadei, G.Chillemi, M.A.Ceruso, A.Grottesi, and A.Di Nola TE A small system ensemble Monte Carlo simulation of supersaturated vapor: Evaluation of barrier to nucleation AU K.J.Oh and X.C.Zeng TE Solubilities of small molecules in polyethylene evaluated by a test-particle-insertion method AU Mitsuhiro Fukuda TE Quantum Monte Carlo study of the H{^-} impurity in small helium clusters AU Mose Casalegno, Massimo Mella, Gabriele Morosi, and Dario Bressanini TE Integral equation theory for polyelectrolyte soluions containing counterions and coions AU Ludger Harnau and Peter Reineker TE Molecular dynamics simulation of limiting conducances for LiCl, NaBr, and CsBr in supercritical water AU S.H.Lee and P.T.Cummings TE Gated escaping of ligand out of protein AU Sheh-Yi Sheu and Dah-Yen Yang TE Liquid crystal phase transitions in clusters of spherocylinders AU Alison Casey and Peter Harrowell TE Test of a simple and flexible molecule model for {alpha}-, {beta}- and {gamma}-S{_8} crystals AU C.Pastorino and Z.Gamba TE Pattern formation in a thin random copolymer film: Evolution of an intermediate morphology AU J-L.Masson and P.F.Green TE Kinetics study on the hydrogen atom-induced abstracion and associative desorption of deuterium adatoms from the Si(100) surface at 573K AU S.Shimokawa, A.Namiki, T.Ando, Y.Sato, and J.Lee TE Electron-hole pair excitation in molecule-surface collisions AU Gert D.Billing