The Journal of Chemical Physics, 2001, V 114, N 6, February 8.
TE Dynamics of excited-state proton transfer systems via
time-resolved photoelectron spectroscopy
AU S.Lochbrunner, T.Schultz, M.Schmitt, J.P.Shaffer, M.Z.Zgierski,
and Albert Stolow
PP 2519-2522
TE Softened C-H modes of adsorbed methyl and their implications for
dehydrogenation: An ab initio study
AU A.Michaelides and P.Hu
PP 2523-2526
ARTICLES
TE On the use of graph invariants for efficiently generating
hydrogen bond topologies and predicting physical properties of
water clusters and ice
AU Jer-Lai Kuo, James V.Coe, Sherwin J.Singer, Yehuda B.Band,
and Lars Ojamaee
PP 2527-2540
TE The conformational behavior of polyglycine as predicted by a
density functional model with periodic boundary conditions
AU Roberto Improta, Vincenzo Barone, Konstantin N.Kudin,
and Gustavo E.Scuseria
PP 2541-2549
TE Photoabsorption spectra in the continuum of molecules and atomic
clusters
AU Takashi Nakatsukasa and Kazuhiro Yabana
PP 2550-2561
TE Semiclassical description of quantum coherence effects and their
quenching: A forward-backward initial value representation study
AU Haobin Wang, Michael Thoss, Kathy L.Sorge, Ricard Gelabert,
Xavier Gimenez, and William H.Miller
PP 2562-2571
TE Semiclassical description of diffraction and its quenching by
the forward-backward version of the initial value representation
AU Ricard Gelabert, Xavier Gimenez, Michael Thoss, Haobin Wang,
and William H.Miller
PP 2572-2579
TE A Fukui function overlap method for predicting reactivity in
sterically complex systems
AU Louis A.Clark, Donald E.Ellis, and Randall Q.Snurr
PP 2580-2591
TE The improved virtual orbital-complete active space configuration
interaction method, a "packageable" efficient ab initio
many-body method for describing electronically excited states
AU Davin M.Potts, Caroline M.Taylor, Rajat K.Chaudhuri, and Karl F.Freed
PP 2592-2600
TE Nuclear dynamics near conical intersections in the adiabatic
representation: I. The effects of local topography on interstate
transitions
AU David R.Yarkony
PP 2601-2613
TE Characterizing the local topography of conical intersections
using orthogonality constrained parameters: Application to the
internal conversion S_{1}-->S_{0} in HNCO
AU David R.Yarkony
PP 2614-2622
TE Vibrational spectra of the methanol tetramer in the OH stretch
region. Two cyclic isomers and concerted proton tunneling
AU Mikhail V.Vener and Joachim Sauer
PP 2623-2628
TE Continuum state spectroscopy: A high resolution ion imaging
study of IBr photolysis in the wavelength range 440-685 nm
AU Eckart Wrede, Stefan Laubach, Sonja Schulenburg, Alex Brown,
Eloy R.Wouters, Andrew J.Orr-Ewing, and Michael N.R.Ashfold
PP 2629-2646
TE Ab initio studies of the reactions of M(^{1}S,^{3}P, and ^{1}P)
with GeH_{4} (M=Cd, Hg)
AU H.Luna-Garcia, A.Ramirez-Solis, and S.Castillo
PP 2647-2652
TE Negative ion photoelectron spectroscopy of the group 5 metal
trimer monoxides V_{3}O, Nb_{3}O, and Ta_{3}O
AU Susan M.E.Green, Simson Alex, Nancy L.Fleischer, Evan L.Millam,
Timothy P.Marcy, and Doreen G.Leopold
PP 2653-2668
TE Differential cross sections for rotationally inelastic
scattering of NO from He and D_{2}
AU M.S.Westley, K.T.Lorenz, D.W.Chandler, and P.L.Houston
PP 2669-2680
TE Effect of carrier-gas pressure on barrier to nucleation: Monte
Carlo simulation of water/nitrogen system
AU K.J.Oh and X.C.Zeng
PP 2681-2686
TE A theoretical study of the polarized neutron scattering from Cs_{3}CoCl_{5}
AU Zucheng Li, Dylan Jayatilaka, Brian N.Figgis, and Graham S.Chandler
PP 2687-2697
TE Hydration of a structured excess charge distribution: Infrared
spectroscopy of the O_{2}^{-}-(H_{2}O)_{n}, (1 < n < 5) clusters
AU J.Mathias Weber, Jude A.Kelley, William H.Robertson,
and Mark A.Johnson
PP 2698-2706
TE Raman microprobe polarization measurements as a tool for
studying the structure and orientation of molecules and clusters
incorporated into cubic zeolites: S_{8} and Se_{12} rings in zeolite A
AU Vladimir V.Poborchii
PP 2707-2717
TE Nonexponential dielectric relaxation dynamics in supercooled
liquid and glassy states of isoamyl bromide and 2-methylpentane mixtures
AU O.E.Kalinovskaya and J.K.Vij
PP 2718-2726
TE Isotope-edited two-dimensional vibrational spectroscopy of
trialanine in aqueous solution
AU S.Woutersen and P.Hamm
PP 2727-2737
TE Computer simulation study of the velocity cross correlations
between neighboring atoms in simple liquid binary mixtures
AU A.Verdaguer and J.A.Padro
PP 2738-2744
TE Size selectivity in a confined polydisperse hard-disk fluid
AU Soon-Chul Kim and Soong-Hyuck Suh
PP 2745-2750
TE Study of ion desorption induced by carbon core excitation for
poly-methylmethacrylate thin film using electron-ion coincidence spectroscopy
AU E.Ikenaga, K.Isari, K.Kudara, Y.Yasui, S.A.Sardar, S.Wada,
T.Sekitani, K.Tanaka, K.Mase, and S.Tanaka
PP 2751-2759
TE Tuning the spectral and temporal response in PtAu core-shell
nanoparticles
AU Jose H.Hodak, Arnim Henglein, and Gregory V.Hartland
PP 2760-2765
TE Cycloaddition reaction of furan with Si(100)-2x1
AU M.H.Qiao, F.Tao, Y.Cao, Z.H.Li, W.L.Dai, J.F.Deng, and G.Q.Xu
PP 2766-2774
TE Theory and numerical study of exciton dynamics in a disordered linear chain
AU Makoto Shimizu, Shozo Suto, and Takenari Goto
PP 2775-2783
TE Wetting of methanol on the n-alkanes: Observation of short-range
critical wetting
AU David Ross, Daniel Bonn, and Jacques Meunier
PP 2784-2792
TE Nucleation in a slit pore
AU V.Talanquer and D.W.Oxtoby
PP 2793-2801
TE The effect of chain density on the frictional behavior of
surfaces modified with alkylsiloxanes and immersed in n-alcohols
AU Susannah C.Clear and Paul F.Nealey
PP 2802-2811
TE Reversible adsorption of calcium ions by imprinted temperature
sensitive gels
AU Carmen Alvarez-Lorenzo, Orhan Guney, Taro Oya, Yasuzo Sakai,
Masatoshi Kobayashi, Takashi Enoki, Yukikazu Takeoka,
Toru Ishibashi, Kenichi Kuroda, Kazunori Tanaka, Guoqiang Wang,
Alexander Yu.Grosberg, Satoru Masamune, and Toyoichi Tanaka
PP 2812-2816
TE Molecular dynamics computer simulations of solvation dynamics at
liquid/liquid interfaces
AU David Michael and Ilan Benjamin
PP 2817-2824
TE An experimental study of the occupied volume in polyethylene
terephthalate
AU G.Consolati and F.Quasso
PP 2825-2829
TE The effect of acid-base equilibria on the fractional charge and
conformational properties of polyelectrolyte solutions
AU Chwen-Yang Shew and Arun Yethiraj
PP 2830-2838
TE Structure factors effects in small-angle scattering from block
copolymer micelles and star polymers
AU Jan Skov Pedersen
PP 2839-2846
TE Self-consistent integral equation theory for polyolefins:
Comparison to molecular dynamics simulations and x-ray scattering
AU Mathias Puetz, John G.Curro, and Gary S.Grest
PP 2847-2860
LETTERS TO THE EDITOR
TE Erratum: "Efficiency of encounter-controlled reaction between
diffusing reactants in a finite lattice" [J. Chem. Phys., v.113, 8168 (2000)]
AU John J.Kozak, C.Nicolis, and B.Nicolis
PP 2861