Journal of Chemical Physics, 1998, V 108, N 15, 15 Apr.
TE Comment on: Thermochemistry of gaseous SiO(OH),SiO(OH)_{2},
and SiO_{2}
[J.Chem.Phys.101, 6076 (1994)]
AU D.L.Hildenbrand and K.H.Lau
TE Quantum mechanical calculation of inelastic scattering of an
atom by a large anharmonic cluster. Application to He + Ar_{13}
AU A.Y.Rom, D.Neuhauser, and R.B.Gerber
TE Wave packet interferometry without phase-locking
AU C.Leichtle, W.P.Schleich, I.Sh.Averbukh, and M.Shapiro
TE High resolution vacuum ultraviolet pulsed field ionization
photoelectron band for OCS^{+}(X^{2}{PI}). An experimental
and theoretical study
AU S.Stimson, M.Evans, C.Y.Ng, C.-W.Hsu, P.Heimann, C.Destandau,
G.Chambaud, and P.Rosmus
TE One-electron resonances and computed cross sections
in electron scattering from the benzene molecules
AU F.A.Gianturco and R.R.Lucchese
TE Proton and deuteron spin-lattice relaxation times in HD-Ar
mixtures. A combined experimental and theoretical study
AU Hassan Sabzyan, William P.Power, and Frederick R.W.McCourt
TE Experimental and quantum mechanical study of the
H+D_{2} reaction near 0.5 eV. The assessment of the
H_{3} potential energy surfaces
AU Luis Banares, F.J.Aoiz, Victor J.Herrero,
Michael J.D'Mello, Brita Niederjohann,
Karen Seekamp-Rahn, Eckart Wrede, and E.W.Ludger
TE High resolution threshold photoelectron spectra of
molecular oxygen in the 18-24 eV region
AU T.Tanaka, H.Yoshii, T.Hayaishi, K.Ito, R.I.Hall, and Y.Morioka
TE Structure and dynamics of intermediate benzene-argon clusters:
(C_{6}H_{6})Ar_{n}, n=13-40
AU David C.Easter, Lino Bailey, James Mellott,
Michael Tirres, and Todd Weiss
TE Formation of the trimer ion core in the heterogeneous
rare gas cluster ions
AU Kenzo Hiraoka, Akitaka Shimizu, Akihito Minamitsu,
Masayuki Nasu, Hiroaki Wasada, and Shinichi Yamabe
TE Photoionization spectra and ionization energies of HSCl, HSSSH,
SSCl and HSSCl formed in the reaction system Cl/Cl_{2}/H_{2}S
AU Jurg Eberhard, Wei-Chen Chen, Chin-hui Yu, Yuan-Pern Lee,
and Bing-Ming Cheng
TE Density functional theory with an approximate kinetic energy
functional applied to study structure and stability of weak
van der Waals complexes
AU T.A.Wesolowski, Y.Ellinger, and J.Weber
TE Theoretical study of the dipole-bound anion (H_{2}O...NH_{3})^{-}
AU Piotr Skurski and Maciej Gutowski
TE Degenerate four-wave mixing spectroscopy as a probe of
orientation and alignment in molecular systems
AU Thierry A.W.Wasserman, Patrick H.Vaccaro and Bruce R.Johnson
TE Molecular and dissociative chemisorption of NO on palladium
and rhodium (100) and (111) surfaces.
A density-functional periodic study
AU D.Loffreda, D.Simon, and P.Sautet
TE A study of the CS molecule with photoelectron
spectroscopy using synchrotron radiation
AU John M.Dyke, Stuart D.Gamblin, Darren Haggerston,
Alan Morris, Stefano Stranges, John B.West,
Timothy G.Wright, and Andrew E.Wright
TE The hyperpolarizability of trans- butadiene re-revisited
AU Piotr B.Rozyczko and Rodney J.Bartlett
TE Absorption spectroscopy of SiH_{2} near 640nm
AU Rafael Escribano and Alain Campargue
TE Vacuum ultraviolet photodissociation dynamics of acetonitrile
AU Masashi Moriyama, Yoshiya Tsutsui, and Kenji Honma
TE The quantum threshold behaviour of the Na + HF reaction
AU R.Gargano, S.Crocchianti, L.Lagana, and G.A.Parker
TE Comparative Raman spectroscopy of nitromethane-h_{3},
nitromethane-d_{3} and nitroethane up to 20 GPa
AU Stephane Courtecuisse, Francois Cansell,
Denise Fabre, and Jean Pierre Petitet
TE State resolved collisional relaxation of highly
vibrationally excited pyridine by CO_{2}.
Influence of a permanent dipole moment
AU Mark C.Wall, Brian A.Stewart, and Amy S.Mullin
TE On the spectrum and structure of the isolated
O_{4}^{-} anion in solid argon
AU G.V.Chertihin and L.Andrews
TE A point-charge model for the nuclear quadrupole moment.
Coupled-cluster, Dirac-Fock, Douglas-Kroll and nonrelativistic
Hartree-Fock calculations for the Cu and F electric field ...
AU Markus Pernpointner, Michael Seth, and Peter Schwerdtfeger
TE The nuclear quadrupole moment of ^{133}Cs. Accurate
relativistic coupled cluster calculations for CsF within
the point-charge model for nuclear quadrupole moments
AU Markus Pernpointner, Peter Schwerdtfeger, and Bernd A.Hess
TE Laser spectroscopy and crystal field analysis of
Cm^{3+} diluted in Cs_{2}NaYCl_{6}
AU K.M.Murdoch, R.Cavellec, E.Simoni, M.Karbowiak, S.Hubert,
M.Illemassene, and N.M.Edelstein
TE Direct observation of the ionization threshold of
triplet methylene by phototionization mass spectrometry
AU Maritoni Litorja and Branko Ruscic
TE Discrete energy representation and generalized
propagation of physical systems
AU Rongqing Chen and Hua Guo
TE Effects of diffusion on xenon gas MRI
AU Yi-Qiao Song, Boyd M.Goodson, Bhima Sheridan, Thomas M.de Swiet,
and Alexander Pines
TE Theoretical study of the sum frequency generation in molecular
adsorbate. NH_{3} /MgO(100)
AU V.Pouthier, C.Ramseyer, and C.Giardet
TE A nonlocal current density functional for magnetic responses
AU Freddie R.Salsbury Jr.and Robert A.Harris
TE Effects of complex formation on low energy
H^{+} + O_{2}(X^{3}{SIGMA}_{g}^{-}, v=0) --> H + charge transfer
AU D Grimbert, V.Sidis, and V.Cobut
TE Dispersion solute-solvent coupling in electron
transfer reactions. I. Effective potential
AU Dmitry V.Matyushov and Branka M.Ladanyi
TE Electron affinities of CO_{2}, OCS, and CS_{2}
AU Gennady L.Gutsev, Rodney J.Bartlett, and Robert N.Compton
TE Interaction of a magnetic field with the
a'^{3}{SIGMA}^{+} - A^{1}{PI} complex in CO
AU Thomas Sykora and C.R.Vidal
TE Non-statistical bond breaking in the multiphoton
ionization/dissociation of [Fe(CO)_{5}]_{m}Ar_{n} clusters
AU S.Bililign, C.S.Feigerle, John C.Miller, and M.Velegrakis
TE X-ray natural circular dichroism in a uniaxial
gyrotropic single crystal of LiIO_{3}
AU Jose Goulon, Chantal Goulon-Ginet, Andrei Rogalev, Vincent Gotte,
Cecile Malgrange, Christian Brouder, and Calogero R.Natoli
TE Role of vibrational softening in fast dynamics
of an amorphous polyimide far below Tg
AU J.Hansen, T.Kanaya, K.Nishida, K.Kaji, K.Tanaka, and A.Yamaguchi
TE Orientations and phase transitions in uncrosslinked
and crosslinked polymer liquid crystals
AU Witold Brostow, Kazimierz Hibner, and Janusz Walasek
TE Alternative schemes for the inclusion of a reaction-field correction
into molecular dynamics simulations. Influence on the simulated
energetic, structural and dielectric properties of liquid water
AU Philippe H.Huenenberger and Wilfred F.van Gunsteren
TE Dynamics of glass-forming liquids. IV. True activated behaviour
above 2 GHz in the dielectric {alpha}-relaxation of organic liquids
AU C.Hansen, F.Stickel, R.Richert, and E.W.Fischer
TE A quantum statistical mechanical study of the
enthalpy of formation of the water dimer
AU Gregory K.Schenter
TE An investigation of dynamical density functional
theory for solvation in simple mixtures
AU Akira Yoshimori, Tyler J.F.Day, and G.N.Patey
TE Solvation dynamics. The role of hydrogen bonding
AU G.Sese and J.A.Padro
TE Microcanonical temperature and heat capacity computation of
Lennard-Jones clusters under isoergic molecular dynamics simulation
AU Umesh A.Salian
TE Validation of molecular dynamics simulation
AU Wilfred F.van Gunsteren and Alan E.Mark
TE Self-diffusion of charged colloidal tracer spheres in transparent
porous glass media. Effect of ionic strength and pore size
AU Sebastiaan G.J.M.Kluijtmans, Els H.A.De Hoog, and Albert P.Philipse
TE Erratum: Time correlation functions for mixed
quantum-semiclassical systems
[J.Chem.Phys.107, 7314 (1997)]
AU J.Liam McWhirter
TE Primitive models of chemical association. III. Totally
flexible sticky two-point model for multicomponent
heteronuclear fixed-chain-length polymerization
AU C.-T.Lin, Yu.V.Kalyuzhnyi, and G.Stell
TE Primitive models of chemical association. IV. Polymer Percus-Yevick
ideal-chain approximation for heteronuclear hard-sphere chain fluids
AU Yu.V.Kalyuzhnyi, C.-T.Lin, and G.Stell
TE Simple liquids confined to molecularly thin layers.
I.Confinement-induced liquid-to-solid phase transitions
AU Jacob Klein and Eugenia Kumacheva
TE Simple liquids confined to molecularly thin layers.
II. Shear and frictional behaviour of solidified films
AU Eugenia Kumacheva and Jacob Klein
TE Excitation energy transport and conformational-librational
motion in chains
AU T.Palszegi, B.Mollay, and H.F.Kauffmann
TE Static structure of polydisperse colloidal monolayers
AU F.Lado
TE Dielectric relaxation in binary solutions.
Theory and experimental results
AU Davide Bertolini, Mario Cassettari,
Carlo Ferrari, and Elpidio Tombari