Journal of Chemical Physics
15 Jan 1998, V108, N3.
%T NMR excitation of quadrupolar order using
adiabatic demagnetization in the rotating
frame
%A Colan E. Hughes, Richard Kemp-Harper, and
Stephen Wimperis
%T Spin uncoupling in surface chemisorption of unsat-
urated hydrocarbons
%A Luciano Triguero, Larls G.M. Pettersson,
Boris Minaev, and Hans Agren
%T Spectroscopic determination of {DELTA}H{^0} for axial/ equa-
torial and ethyl rotor conformations in 4-methyl and
4-ethyl cyclohexanone cooled in a supersonic jet
%A Alan R. Potts and Tomas Baer
%T Kinetic energies of C{_n}{^+} fragment ions (58 >n> 4)
produced by electron impact on C{_60}
%A D. Muigg, G. Denifl, P. Scheier, K. Becker, and
T.D. Mark
%T A unified model of the dynamics and spectroscopy
of the g{^3}{1/2}{_0}{^-} and E{^1}{1/2}{^+} states of hydrogen
chloride
%A Alex Strizhev, Xiaonong Li, Rohana Liyanage,
Robert Gordon, and Robert W. Field
%T An ab initio investigation of spin-allowed and
spin-forbidden pathways of the gas phase reac-
tions of O({^3}P) + C{_2}H{_5}I
%A Jonathan E. Stevens, Qiang Cui, and Keiji Moroukuma
%T Vibration-torsion-rotation polarizability tensor
operator for a molecule with an internal rotor
%A Zhen-Dong Sun, Yun-Bo Duan, and Jun Xu
%T The phosphorescence excitation spectrum of biacetyl.
An analysis of the acetyl and methyl torsional mode
structure
%A D.C. Moule, A.C. Sharp, H. Liu, E.C. Lim,
and R.H. Judge
%T B3LYP-DFT characterisation of the potential energy
surface of the CH(X{^2}{PI}) + C{_2}H{_2} reaction
%A Luc Vereecken, Kristine Pierloot, and
Jozef Peeters
%T Dynamical catalysis
%A J.M. Deutch
%T Molecular integrals over real solid spherical
Gaussian-type functions
%A Osamu Matsuoka
%T Comment on: A study of HEI photoelectron spectroscopy
on the electronic structure of the nitrate free
radical NO3
[J. Chem. Phys. 106, 3003 (1997)]
%A P.S. Monks, L.J. Stief, M. Krauss, S.C. Kuo,
Z. Zhang, and R.B. Klemm
%T Reply to the Comment on: A study of HeI photoelectron
spectroscopy on the electronic structure of the nitrate
free radical NO{_3}. What does exactly the informa-
tion contents of the HeI photoelectron spectroscopy mean?
%A Wang Dianxun, Jiang Peng, Qian Ximei, and
Hong Gongyi
%T The semiclassical calculation of nonadiabatic
tunneling rates
%A Charles D. Schwieters and Gregory A. Voth
%T A nondiagonal, renormalized extension of partial
third order quasiparticle theory. Comparisons
for closed-shell ionization energies
%A J.V. Ortiz
%T Vacuum-UV fluorescence spectroscopy of PF{_3} in
the range 9 - 20 eV
%A H. Biehl, K.J. Boyle, D.P. Seccombe,
R.P. Tuckett, H. Baumgartel, and
H.W. Jochims
%T The electron affinities of PF and PF{_2}
%A Jiande Gu, Kaixian Chen, Yaoming Xie,
Henry F. Schaefer III, Robert A. Harris,
and A.A. Viggiano
%T Electron impact dissociative ionization of CO{_2}.
Measurements with a focusing time-of-flight
mass spectrometer
%A Cechan Tian and C.R. Vidal
%T Quantum mechanical and semiclassical studies of
N + N{_2} collisions and their application to ther-
malization of fast N atoms
%A N. Balakrishnan, V. Kharchenko, and A. Dalgarno
%T An ab initio study of the dissociation of HNCO
in the S{_1} electronic state
%A Jonathan E. Stevens, Qiang Cui, and
Keiji Morokuma
%T Structures and vibrational frequencies in the full
configuration interaction limit. Predictions for
four electronic states of methylene using a triple-
zeta plus double polarization (TZ2P) basis
%A C. David Sherrill, Matthew L. Leininger,
Timothy J. Van Huis, and Henry F. Schaefer III
%T High resolution spectroscopy of BaCH{_3}(X{^~2}A{_1}).
Fine and hyperfine structure analysis
%A J. Xin, J.S. Robinson, A.J. Apponi, and
L.M. Ziurys
%T Spin locking of I=3/2 nuclei in static and
spinning samples. A description by abstract
spins and Floquet formalism
%A Gunnar Jeschke
%T Photoelectron spectroscopy of OH{^-}(N{_2}O){_n=1-5}
%A Joseph B. Kim, Paul G. Wenthold, and
W.C. Lineberger
%T Modeling Lewis acidity of transition aluminas by
numerical simulations
%A Luis Javier Alvarez, Alexander L. Blumenfeld
and Jose J. Fripiat
%T New inter-Rydberg transitions of NO revealed by
the laser induced amplified spontaneous emission
%A Yoshihiro Ogi, Akihiro Sugita, Hidefumi Suzuki,
Yoshihito Tanaka, and Koichi Tsukiyama
%T Vibrationally-resolved photoelectron spectroscopy of
silicon cluster anions Si{_n} {^-}(n=3-7)
%A Cangshan Xu, Travis R. Taylor, Gordon R. Burton,
and Daniel M. Neumark
%T Quantum dynamics with real wavepackets, including
application to three-dimensional (J=0) D + H{_2}
--> HD + H reactive scattering
%A Stephen K. Gray and Gabriel G. Balint-Kurti
%T Reduced density matrix description of gas-solid
interactions. Scattering, trapping and desorption
%A Bret Jackson
%T Vibration-torsion-rotation analysis of the
{nu}{_12} band of CH{_3}CD{_3}
%A N. Moazzen-Ahmadi, I. Ozier,
I. Mukhopadhyay, and A.R.W. McKellar
%T Ab initio study gas-phase sulphuric acid
hydrates containing 1 to 3 water molecules
%A Hanna Arstila, Kari Laasonen, and
Ari Laaksonen
%T A comparision of molecular hyperpolarizabilities
from gas and liquid phase measurements
%A Philip Kaatz, Elizabeth A. Donley, and
David P. Shelton
%T Stochastic gating influence on the kinetics of
diffusion-limited reactions
%A Yurii A. Makhnovskii, Alexander M. Berezhkovskii,
Sheh-Yi Sheu, Dah-Yenn Yang, Jimmy Kuo, and
Sheng Hsien Lin
%T A scalable parallel algorithm for the MRCI method
for distributed memory architectures
%A F. Stephan and W. Wenzel
%T Reversal of radio-frequency-driven spin diffusion
by reorientation of the sample spinning axis
%A Susan M. De Paul, Marco Tomaselli,
Alexander Pines, Matthias Ernst, and
Beat H. Meier
%T An advanced dielectric continuum approach for
treating solvaton effects. Time correlation
functions. I. Local treatment
%A M.V. Basilevsky, D.F. Parsons, and
M.V. Vener
%T Kinetic description of diffusion-limited
reactions in random catalytic media
%A G. Oshanin and A. Blumen
%T Mean field curvature corrections to the
surface tension
%A A.E. van Giessen, E.M. Blokhuis, and
Dirk Jan Bukman
%T Electrophoresis of polyampholytes
%A Didier Long, Andrey V. Dobrynin,
Michael Rubinstein, and Armand Ajdari
%T Cooperative sequential adsorption processes on
heterogeneous substrates
%A D.J. Stacchiola, M. Ciacera, C. Zuppa,
T.P. Eggarter, and G. Zgrablich
%T The fast cooling/heating rate effects in devitri-
fication of glasses. I. Number of nucleated par-
ticles
%A V.A. Shneidman and D.R. Uhlmann
%T Swelling of colloidal systems
%A Efrosini Kokkoli and Frank van Swol
%T Parallel and vertical morphologies in block
copolymers of cylindrical domain
%A K.Y. Suh, Y.S. Kim, and Hong H. Lee
%T Polyisoprene local dynamics in solution. Comparison
between molecular dynamics simulations and optimized
Rouse-Zimm local dynamics
%A Angelo Perico, Neil E. Moe, and
M.D. Ediger
%T A locally analytic density functional theory
describing adsorption and condensation in
microporous materials
%A Robert H. Nilson and Stewart K. Griffiths
%T Mode-coupling theory of self-diffusion in
diblock copolymers. I. General derivation
and qualitative predictions
%A Marina Guenza, Hai Tang, and Kenneth S. Schweizer
%T Mode-coupling theory of self-diffusion in
diblock copolymers. II. Model calcula-
tions and experimental comparisons
%A Marina Guenza and Kenneth S. Schweizer
%T Viscosity coefficients of nematic hard
particle fluids
%A Glenn T. Evans
%T Anomalous low frequency dispersion and dielec-
tric relaxation in the layered intercalated
compounds of Cd{_0.75}PS{_3}A{_0.5}(H{_2}O) [A=K,C{_s}]
%A P. Jeevanandam and S. Vasudevan
%T Continuum elastic theory of adsorbate vibrational
relaxation
%A Steven P. Lewis, M.V. Pykhtin, E.J. Mele,
and Andrew M. Rappe
%T An NMR study of higher-order correlation
functions in supercooled ortho-terphenyl
%A R. Boehmer, G. Diezemann, G. Hinze, and
H. Sillescu
%T Effective polarizabilities and local field
corrections for nonlinear optical experi-
ments in condensed media
%A Rudiger Woertmann and David M. Bishop
%T Electrostatics of multilamellar vesicles. Legendre
expansion and reaction-field Brownian dynamics
%A Veaceslav Zaloj and Noam Agmon
%T Intermittency of droplet growth in phase separa-
tion of off-critical polymer mixtures
%A Hiroyuki Takeno and Takeji Hashimoto
%T Ab initio band structure of polymethineimine
isomers
%A Denis Jacquemin, Benoit Champagne, and
Jean-Marie Andre
%T Thermodynamic scaling Monte Carlo study of the
liquid-gas transition in the square-well fluid
%A Nikolai V. Brilliantov and John P. Valleau
%T Effective Hamiltonian analysis of fluid criti-
cality and application to the square-well fluid
%A Nikolai V. Brilliantov and John P. Valleau
%T Optical spectra of liquid water in vacuum UV
region by means of inelastic x-ray scattering
spectroscopy
%A Hisashi Hayashi, Noboru Watanabe,
Yasuo Udagawa, and C.-C. Kao