The Journal of Chemical Physics, 2001, V 114, N 3, 15 January.
TE A quantum-mechanical study of the dynamics of the
O(^{1}D)+H_{2}-->OH+H insertion reaction
AU Pascal Honvault and Jean-Michel Launay
PP 1057-1059
ARTICLES
TE Semiclassical application of the Moller operators in
Reactive scattering
AU Sophya Garashchuk and John C.Light
PP 1060-1064
TE Classical mapping approaches for nonadiabatic
dynamics: Short
time analysis
AU Andrei A.Golosov and David R.Reichman
PP 1065-1074
TE Quantum time correlation functions from complex time Monte Carlo
simulations: A maximum entropy approach
AU Goran Krilov, Eunji Sim, and B.J.Berne
PP 1075-1088
TE A quantum electrodynamical theory of three-center energy
transfer for upconversion and downconversion in rare earth doped materials
AU David L.Andrews and Robert D.Jenkins
PP 1089-1100
TE A diagrammatic theory of time correlation functions of
facilitated kinetic Ising models
AU Steven J.Pitts and Hans C.Andersen
PP 1101-1114
TE Computational method of many-electron integrals over explicitly
correlated Cartesian Gaussian functions
AU Shiro L.Saito and Yoshi-ichi Suzuki
PP 1115-1124
TE Compact parameter set for fast estimation of proton transfer rates
AU Markus A.Lill and Volkhard Helms
PP 1125-1132
TE Second-order quasi-degenerate perturbation theory with
quasi-complete active space self-consistent field reference functions
AU Haruyuki Nakano, Junji Nakatani, and Kimihiko Hirao
PP 1133-1141
TE Statistics of the bleaching number and the bleaching time in
single-molecule fluorescence spectroscopy
AU Andrzej Molski
PP 1142-1147
TE Magnetic exchange interaction in a pair of orbitally degenerate
ions: Magnetic anisotropy of [Ti_{2}Cl_{9}]^{-3}
AU J.J.Borras-Almenar, J.M.Clemente-Juan, E.Coronado, A.V.Palii,
and B.S.Tsukerblat
PP 1148-1164
TE Reactivity and electronic structure of aluminum clusters: The
aluminum-nitrogen system
AU B.D.Leskiw, A.W.Castleman, Jr., C.Ashman, and S.N.Khanna
PP 1165-1169
TE Absolute total and partial cross sections for the electron
impact ionization of tetrafluorosilane (SiF_{4})
AU R.Basner, M.Schmidt, E.Denisov, K.Becker, and H.Deutsch
PP 1170-1177
TE Optical pumping studies of vibrational energy transfer in
high-pressure diatomic gases
AU Wonchul Lee, Igor V.Adamovich, and Walter R.Lempert
PP 1178-1186
TE Spectra of jet-cooled ^{32}SO_{2} and ^{34}SO_{2} in systems
a~ ^{3}B_{1} and b~ ^{3}A_{2}-X~ ^{1}A_{1}: Rotational structure
of perturbed b~ ^{3}A_{2}
AU Cheng-Liang Huang, I-Chia Chen, Anthony J.Merer, Chi-Kung Ni,
and A.H.Kung
PP 1187-1193
TE Electronic continua in time-resolved photoelectron spectroscopy.
I. Complementary ionization correlations
AU V.Blanchet, M.Z.Zgierski, and Albert Stolow
PP 1194-1205
TE Electronic continua in time-resolved photoelectron spectroscopy.
II. Corresponding ionization correlations
AU M.Schmitt, S.Lochbrunner, J.P.Shaffer, J.J.Larsen, M.Z.Zgierski,
and Albert Stolow
PP 1206-1213
TE Mechanism of the reaction, CH_{4}+O(^{1}D_{2})-->CH_{3}+OH,
studied by ultrafast and state-resolved photolysis/probe
spectroscopy of the CH_{4}-O_{3} van der Waals complex
AU C.Cameron Miller, Roger D.van Zee, and John C.Stephenson
PP 1214-1232
TE Efficient calculation of molecular constants and transition
intensities in weakly bound species from J=0 eigenstates: Benzene-Ar as test
case
AU Peter M.Felker, Daniel Neuhauser, and Wousik Kim
PP 1233-1241
TE Rotational spectra and structures of the Ar_{3}-H_{2}O and
Ar_{3}-H_{2}S symmetric tops
AU E.Arunan, T.Emilsson, H.S.Gutowsky, and C.E.Dykstra
PP 1242-1248
TE Quantum-mechanical study of vibrational relaxation of HF in
collisions with Ar atoms
AU Roman V.Krems, Nikola Markovic, Alexei A.Buchachenko,
and Sture Nordholm
PP 1249-1258
TE Quantum dynamics simulation of the ultrafast photoionization of Li_{2}
AU Lorenzo Pesce, Zohar Amitay, Radoslaw Uberna, Stephen R.Leone,
Mark Ratner, and Ronnie Kosloff
PP 1259-1271
TE Electronic structure and polarizabilities of icosahedral
fullerenes: A Pariser-Parr-Pople approach
AU A.Ruiz, J.Breton, and J.M.Gomez Llorente
PP 1272-1277
TE A theoretical study of Si_{4}H_{2} cluster with ab initio and
density functional theory methods
AU Wen-Ning Wang, Hai-Rong Tang, Kang-Nian Fan, and Suehiro Iwata
PP 1278-1285
TE Investigations of pure rotational transitions of H_{2} perturbed
by He. II. High-temperature calculations and extrapolations
AU M.-L.Dubernet, P.A.Tuckey, G.Jolicard, X.Michaut, and H.Berger
PP 1286-1294
TE sigma to pi conformational transition: Interactions of the water
trimer with pi systems
AU P.Tarakeshwar, Kwang S.Kim, and B.Brutschy
PP 1295-1305
TE The permanent electric dipole moment of yttrium dicarbide, YC_{2}
AU Robert R.Bousquet and Timothy C.Steimle
PP 1306-1311
TE Contribution of the ultrafast, short-distance intermolecular
electron transfer to the fluorescence quenching rate in solution
AU Shinichiro Iwai, Shigeo Murata, and M.Tachiya
PP 1312-1318
TE Heterogeneous nucleation on aerosol particles
AU Kira Padilla and V.Talanquer
PP 1319-1325
TE Determining the solvation correlation function from three-pulse
photon echoes in liquids
AU K.F.Everitt, E.Geva, and J.L.Skinner
PP 1326-1335
TE Proton transfer reaction of 4-methyl-2,6-diacetylphenol and an
analysis with AM1 potential-energy surfaces
AU A.Mandal, D.Guha, R.Das, S.Mitra, and S.Mukherjee
PP 1336-1343
TE Surface relief gratings generated by pulsed holography: A simple
way to polymer nanostructures without isomerizing side-chains
AU O.Baldus, A.Leopold, R.Hagen, T.Bieringer, and S.J.Zilker
PP 1344-1349
TE Triple-point wetting of Ne on solid CO_{2}
AU L.Bruschi, E.Paniz, G.Mistura, and G.Galilei
PP 1350-1354
TE Critical phenomena of water bridges in nanoasperity contacts
AU Mingyan He, Amy Szuchmacher Blum, D.Eric Aston,
Cynthia Buenviaje, Rene M.Overney, and Reto Luginbuehl
PP 1355-1360
TE Electrical conductivity of water compressed dynamically to
pressures of 70-180 GPa (0.7-1.8 Mbar)
AU R.Chau, A.C.Mitchell, R.W.Minich, and W.J.Nellis
PP 1361-1365
TE Adsorption of colloidal particles by Brownian dynamics
simulation: Kinetics and surface structures
AU Jeffrey J.Gray and Roger T.Bonnecaze
PP 1366-1381
TE Rotational and diffractive inelastic scattering of a diatom on a
corrugated surface: A multiconfiguration time-dependent Hartree
study on N_{2}/LiF(001)
AU M.-C.Heitz and H.-D.Meyer
PP 1382-1392
TE Photon avalanche in Cs_{2}ZrCl_{6}: Os^{4+}
AU Markus Wermuth and Hans U.Guedel
PP 1393-1404
TE Monte Carlo simulations of Wyoming sodium montmorillonite
hydrates
AU M.Chavez-Paez, K.Van Workum, L.de Pablo, and J.J.de Pablo
PP 1405-1413
TE The adsorption conformation of chemisorbed pyridine on the
Cu(110) surface
AU J.-G.Lee, J.Ahner, and J.T.Yates, Jr.
PP 1414-1419
TE Amino acid classes and the protein folding problem
AU Marek Cieplak, Neal S.Holter, Amos Maritan, and Jayanth R.Banavar
PP 1420-1423
TE Monte Carlo test of the lattice cluster theory: Thermodynamic
properties of binary polymer blends
AU Dorel Buta, Karl F.Freed, and Igal Szleifer
PP 1424-1431
TE Chain self-assembly and phase transitions in semiflexible
polymer systems
AU James T.Kindt and William M.Gelbart
PP 1432-1439
LETTERS TO THE EDITOR
TE Erratum: "Mechanism of fast proton transfer in ice: Potential
energy surface and reaction coordinate analyses"
[J. Chem. Phys., v.113, 9090 (2000)]
AU Chigusa Kobayashi, Shinji Saito, and Iwao Ohmine
PP 1440