Journal of Chemical Physics, 1999, V 111, N 2, 8 Jul.
TE Experimental and theoretical ab initio study of the influence of
N-methylation on the dipole-bound elecron affinities of thymine
and uracil
AU C.Desfrancois, H.Abdoul-Carime, S.Carles, V.Periquet,
J.P.Schermann, Dayle M.A.Smith, and Ludwik Adamowicz
TE Potential surfaces from the inversion of time dependent
probability density data
AU Wusheng Zhu and Herschel Rabitz
TE Scalar and vector properties of the NO(v'=0) produced from the
reaction O({^1}D) + N{_2}O --> NO + NO
AU Hiroshi Tsurumaki, Yo Fujimura, and Okitsugu Kajimoto
TE The vibrational energy pattern in acetylene. V. {^13}C{_2}H{_2}
AU G.Di Lonardo, L.Fusina, E.Venuti, J.W.S.Johns, M.I.El Idrissi,
J.Lievin, and M.Herman
TE High resolution Raman spectroscopy from vibrationally excited
states populated by a stimulated Raman process. Transitions from
V{_2}=2 in {^12}C{_2}H{_2} and {^13}C{_2}HQ&*D2}
AU D.Bermejo, R.Z.Martinez, G.Di Lonardo, and L.Fusina
TE Structure and vibrational dynamics of the benzene dimer
AU Vladimir Spirko, Ola Engkvist, Pavel Soldan, Heinrich L.Selzle,
Edward E.Schlag, and Pavel Hobza
TE Temperature dependent rate constants for the reacions of gas
phase lanthanides with N{_2}O
AU Mark L.Campbell
TE Between vapour and ice: Free water clusters studied by core
level spectroscopy
AU O.Bjorneholm, F.Federmann, S.Kakar, and T.Moller
TE The electronic spectrum, molecular structure, and oscillatory
fluorescence decay of jet-cooled gerylidene (H{_2}C={^74}Ge),
the simplest unsaturated germylene
AU David A.Hostutler, Tony C.Smith, Haiyang Li,
and Dennis J.Clouthier
TE Efficient calculation of matrix elements in low storage filter
diagonalization
AU Rongqing Chen and Hua Guo
TE Real time observation of hydrogen transfer: Femtoecond
time-resolved photoelectron spectroscopy in excited ammonia dimer
AU P.Farmanara, W.Radloff, V.Stert, H.-H.Ritze, and I.V.Hertel
TE Femtosecond photoionization of (H{_2}O){_n} and (D{_2}O){_n}
clusters
AU P.P.Radi, P.Beaud, D.Franzke, H-M.Frey, T.Gerber, B.Mischler,
and A-P.Tzannis
TE Picosecond studies of the intramolecular relaxation processes in
isolated C{_60} and C{_70} molecules
AU A.Sassara, G.Zerza, M.Chergui, V.Ciulin, J.-D.Ganiere,
and B.Deveaud
TE Structures and energetics of Ne{_n}-HN{_2}{^+} clusters
AU Markus Meuwly
TE Hermite polynomial expansions of the error function and related
F{_0}(w) integral
AU K.Kovacevic
TE Spectroscopic characterization of excited
Ca(4s4d{delta}{^3}D{_J}){^.} RG({^3}{DELTA}{_1,2}) states
(RG=Ar, Kr, Xe): No "heavy-atom atom" mixing of RG(nd{delta})
character into the wave-functions
AU Allen W.K.Leung, John G.Kaup, D.Bellert, John G.McCaffrey,
and W.H.Breckenridge
TE Kinetic energy density dependent approximations to the exchange
energy
AU Matthias Ernzerhof and Gustavo E.Scuseria
TE Comparison of methods for calculating the proerties of
intramolecular hydrogen bonds. Excited state proton transfer
AU Tapas Kar, Steve Scheiner, and Martin Cuma
TE The electronic spectrum of pyrrole
AU Ove Christiansen, Jurgen Gauss, John F.Stanton,
and Poul Jorgensen
TE A multiconfigurational self-consistent field study of the
thermal decomposition of methyl azide
AU Juan F.Arenas, Juan I.Marcos, Juan C.Otero,
Adalaida Sanchez-Galvez and Juan Soto
TE Solvent electronic polarization effect on the electronic
transitions in solution: Charge polarizable reference
interaction site model self-consistent field approach
AU Kazunari Naka, Akihiro Morita, and Shigeki Kato
TE Electron-pair momentum densities of group 14, 15, and 16 atoms
in their low-lying electronic states
AU Toshikatsu Koga and Hisashi Matsuyama
TE Brownian dynamics simulations of linear polymers under shear flow
AU Alexey V.Lyulin, David B.Adolf, and Geoffrey R.Davies
TE On the generalized Kramers problem with oscillatory memory
friction
AU Ramon Reigada, Aldo H.Romero, Katja Lindenberg, and Jose M.Sancho
TE A first principle computation of the thermodynamics of glasses
AU Marc Mezard and Giorgio Parisi
TE Molecular dynamics simulation of formamide in water using
density functional theory and classical potentials
AU S.Chalmet and M.F.Ruiz-Lopez
TE Femtosecond spectroscopy of the dissociation and geminate
recombination of aqueous CS{_2}
AU C.L.Thomsen, D.Madsen, J.Thogersen, J.R.Byberg, and S.R.Keiding
TE Surface tension in terms of direct correlation function c(r,r'):
Proposed modelling of c(r,r') through liquid - vapor interface
AU N.H.March and M.P.Tosi
TE From molecular clusters to bulk matter. II. Crossover from
icosahedral to crystalline structures in CO{_2} clusters
AU Jean-Bernard Maillet, Anne Boutin, and Alain H.Fuchs
TE Role of trap clustering in the trapping kinetics
AU Yurii A.Makhnovskii, Alexander M.Berezhkovskii, Sheh-Yi Sheu,
Dah-Yen Yang, and Sheng Hsien Lin
TE Molar excess volumes of liquid hydrogen and neon mixtures from
path integral simulation
AU Sivakumar R.Challa and J.Karl Johnson
TE The dynamics of proton transfer in a water chain
AU Raymond R.Sadeghi and Hai-Ping Cheng
TE Geometric investigation of low-dimensional maniolds in systems
approaching equilibrium
AU Michael J.Davis and Rex T.Skodje
TE Errata: Evolution of dissipative processes via a statistical
thermodynamic approach. I. Generaized Mori-Heisenberg-Langevin
equations [J. Chem. Phys. 108, 7568 (1998)]
AU J.R.Madureira, A.R.Vasconcellos, R.Luzzo, J.Casas-Vazquez,
and D.Jou
TE Isosbestic points in liquid water. Further strong evidence for
the two-state mixture model
AU G.Wilse Robinson, Chul Hee Cho, and Jacob Urquidi