Journal of Chemical Physics
15 Jun 1997, V106, N23.
%T Revinvestigation of the HSiCl electronic spectrum.
Experimental reevaluation of the geometry,
rotational constants and vibrational frequencies
%A Warren W.Harper and Dennis J.Clouthier
%T The absolute cross sections of photoabsorption,
photodissociation, and photoionization of the
group VIB metal hexacarbonyls at 300-1600 A{^0}
%A Fei Qi, Xin Yang, Shihe Yang, Fuyi Liu,
Liusi Sheng, Hui Gao, Yunwu Zhang, and Shuqin Yu
%T Dissociation dynamics of HNCO and DNCO after
laser photoexcitation in the vacuum ultraviolet
%A R.A.Brownsword, T.Laurent, M.Hillenkamp, R.K.Vatsa, and H.-R.Volpp
%T Interfacing relativistic and nonrelativistic methods.
I. Normalized elimination of the small component in
the modified Dirac equation
%A Kenneth G.Dyall
%T Erratum: In-plane structure of the liquid vapor interfaces of
dilute Bismuth-Gallium alloys: X-ray scattering studies
[J.Chem.Phys.105, 9615 (1996)]
%A Ning Lei, Zhenqing Huang, Stuart A.Rice, and Christopher J.Grayce
%T Condensed phase electron-energy-loss spectroscopy of the
low-lying triplet states of acetylene
%A P.Swiderek, M.Michaud, and L.Sanche
%T Low energy collision-induced dissociation and photodissociation
studies of the (N{_2}O,H{_2}O){^+} cluster ion
%A Michael J.Bastian, Rainer A.Dressler, Dale J.Levandier,
Edmond Murad, Felician Muntean, and P.B.Armentrout
%T Basis-set convergence of correlated calculations on water
%A Trygve Helgaker, Wim Klopper, Henrik Koch, and Jozef Noga
%T Mechanism of NH{_2}+CO{_2} formation in OH+HNCO reaction.
Rate constant evaluation via ab initio calculations and
statistical theory
%A Debasis Sengupta and Minh Tho Nguyen
%T The band edge luminescence of surface modified
CdSe nanocrystallites. Probing the luminescing state
%A M.Kuno, J.K.Lee, B.O.Dabbousi, F.V.Mikulec, and M.G.Bawendi
%T Ultraviolet photoelectron spectroscopy of the
chromium dioxide negative ion
%A Paul G.Wenthold, Karl-Ludwig Jonas, and W.C.Lineberger
%T A high level theoretical investigation of the
cyclic hydrogen fluoride trimer
%A Gregory S.Tschumper, Yukio Yamaguchi, and Henry F.Schaefer III
%T Accurate numerical determination of Kohn-Sham potentials
from electronic densities. I.Two-electron systems
%A Michael E.Mura, Peter J.Knowles, and Christopher A.Reynolds
%T Theoretical investigation of the Ar+H{_2}{^+}
(0 ArH{^+}+H non adiabatic reaction dynamics
%A F.Aguillon and M.Sizun
%T Symmetry-adapted perturbation theory of three-body
nonadditivity of intermolecular interaction energy
%A Victor F.Lotrich and Krysztof Szalewicz
%T Symmetry-adapted perturbation theory of three-
body nonadditivity in Ar trimer
%A Victor F.Lotrich and Krzysztof Szalewicz
%T Pump-probe spectroscopy of photoinduced charge
transfer reactions in solution
%A Dah-Yen Yang and Sheh-Yi Sheu
%T Photoionization studies of manganese clusters.
Ionization potentials for Mn{_7} to Mn{_64}
%A Geoffrey M.Koretsky and Mark B.Knickelbein
%T Interaction of small boron cluster ions with HF
%A Marianne B.Sowa-Resat, Jason Smolanoff,
Adam Lapicki, and Scott L.Anderson
%T Determination of local structure in solid
nucleic acids using double quantum NMR spectroscopy
%A D.M.Gregory, M.A.Mehta, J.C.Shiels, and G.P.Drobny
%T Double many-body expansion potential energy surface for ground
state HCN based on realistic long range forces and accurate
ab initio calculations
%A A.J.C.Varandas and S.P.J.Rodrigues
%T Multiphoton He atom scattering from Xe overlayers
on Cu(lll) and Cu(001) surfaces
%A J.Braun, D.Fuhrmann, M.Bertino, A.P.Graham, J.P.Toennies,
A.Bilic, and B.Gumhalter
%T Ligand and metal binding energies in platinum
carbonyl cluster anions. Collision-induced
dissociation of Pt{_m} and Pt{_m}(CO){_n}
%A Alexander Grushow and Kent M.Ervin
%T Ab initio calculations and dynamical tests of a
potential energy surface for the Na + FH reaction
%A Antonio Lagana, Jose M.Alvarino, M.Luz Hernandez, Paolo Palmieri,
Ernesto Garcia, and Teresa Martinez
%T A model for low temperature electrochemical proton transfer.
Temperature and isotope effects on kinetic parameters
%A A.A.Kornyshev, A.M.Kuznetsov, and U.Stimming
%T Mass-resolved two-photon spectra of Xe{_2} in the
region of Xe{^*}(5d). Part I. Vibronic analysis
%A X.K.Hu, D.M.Mao, S.S.Dimov, and R.H.Lipson
%T Mass-resolved two-photon spectra of Xe{_2} in the
region of Xe{^*}(5d). Part II. Dominant ion-core
assignments by dispersive photoelectron spectroscopy
%A X.K.Hu, D.M.Mao, S.S.Dimov, and R.H.Lipson
%T Low-energy dissociative electron attachment to
CFCl{_3}, CF{_2}Br{_2}, and 1,1,1- and 1,1,2-C{_2}Cl{_3}F{_3}.
Intermediate lifetimes and decay energetics
%A C.D.Finch, R.Parthasarathy, H.C.Akpati, P.Nordlander,
and F.B.Dunning
%T Vibrational autoionization in polyatomic molecules
%A Ch.Jungen and S.T.Pratt
%T Electronic structure of CHClBrI
%A Igor Novak, Siu Choon Ng, Shengxi Jin, and Anthony W.Potts
%T Interaction potential of Al{^3+} in water from first
principles calculations
%A Evgeny Wasserman, James R.Rustad, and Sotiris S.Xantheas
%T Variation of dipole-dipole interaction with
rotational state. Experiment and theory
%A E.J.van Duijn, G.Nienhuis, L.J.F.Hermans, and I.Kuscer
%T Fourier-transform microwave spectrum, structure, harmonic force
field and hyperfine constants of sulfur chloride fluoride, CISF
%A Jurgen Preusser and Michael C.L.Gerry
%T Photoionization efficiency spectrum and ionization energy of HSO
studied by discharge flow-photoionization mass spectrometry
%A Bing-Ming Cheng, Jurg Eberhard, Wei-chen Chen, and Chin-hui Yu
%T Fokker-Planck equation for the one-molecule distribution
function in polymer mixtures and its solution
%A C.F.Curtiss and R.Byron Bird
%T Stochastic dynamics simulation of surfactant self-assembly
%A Friedrich K.von Gottberg, Kenneth A.Smith, and T.Alan Hatton
%T Virial/Fisher models of molecular cluster populations
%A I.J.Ford
%T Monte Carlo simulation of athermal mesogenic chains.
Pure systems, mixtures, and constrained environments
%A Fernando A.Escobedo and Juan J.de Pablo
%T Photo induced charge transfer in conducting
polymer C{_60} composites
%A Justin Bruening and Barry Friedman
%T Anomalous clustering and equation-of-state
behavior as the adhesive-disk limit is approached
%A B.Borstnik, C.G.Jesudason, and G.Stell
%T Chemical association of spherical particles
%A G.T.Evans
%T Limited range fractality of randomly adsorbed rods
%A Daniel A.Lidar, Ofer Biham, and David Avnir
%T New statistical mechanical treatment of systems
near surfaces. III. Polydisperse linear and
branched polymers in an interacting solution
%A Mukesh Chhajer and P.D.Gujrati
%T Generation of Maxwell-displacement current across
nematic liquid crystal cells triggered by
conformational changes of surface monolayer
%A Mitsumasa Iwamoto, Woo-Yoen Kim, and Chen-Xu Wu
%T Solvent-induced interactions between hydrophobic and hydrophilic
polyatomic sheets in water and hypothetical nonpolar water
%A Kenichiro Koga, X.C.Zeng, and Hideki Tanaka
%T On the fundamentals of the gradient theory of van der Waals
%A P.M.W.Cornelisse, C.J.Peters, and J.de Swaan Arons
%T Nonequilibrium fluctuation theory on pitting dissolution.
I. Derivation of dissolution current equations
%A Miki Asanuma and Ryoichi Aogaki
%T Nonequilibrium fluctuation theory on pitting dissolution.
II. Determination of surface coverage of nickel passive film
%A Miki Asanuma and Ryoichi Aogaki
%T Nonequilibrium fluctuation theory on pitting dissolution.
III. Experimental examinations on critical fluctuation
and its growth process in nickel dissolution
%A Miki Asanuma and Ryoichi Aogaki
%T Third virial coefficients for saturated square well particles
%A Robin J.Speedy
%T Phase transitions in dipolar fluids. An integral equation study
%A Sabine Klapp and Frank Forstmann
%T Spin diffusion in melts of entangled polymers
%A Elmar Fischer, Rainer Kimmich, and Nail Fatkullin
%T Large scale simulation of macromolecules in solution.
Combining the periodic fast multipole method with
multiple time step integrators
%A Francisco Figueirido, Ronald M.Levy, Ruhong Zhou, and B.J.Berne
%T Lattice vibrations of semirigid molecules. Low-frequency vibrations
of 4,4' - difluorobenzophenone and 4,4' - dichlorobenzophenone
%A D.Kirin and V.Volovsek