Journal of Chemical Physics, 1999, V 110, N24, 22 June.


TE Nondegenerate four-wave mixing spectroscopy of hybrid IR-Raman
   scattering. Two-dimensional vibrational spectroscopy involving
   IR-absorption and Raman scattering processes
AU Ki-Sam Park and Minhaeng Cho

TE Uniform semiclassical calculation of the direct part of the
   photodissociation cross section of water
AU Bruno Hupper and Bruno Eckhardt

TE Classical-quantum correspondence in multiphoton dissociation of
   diatomic molecules by chirped laser pulses
AU Jung-Hoon Kim, Wing-Ki Liu, and Jian-Min Yuan

TE Influence of the chemical environment on the electronic
   structure and spectroscopic proerties of Er{^3+} doped
   Cs{_3}Lu{_2}Cl{_9}, Cs{_3}Lu{_2}Br{_9},and Cs{_3}Y{_2}I{_9}
AU Stefan R.Luthi, Hans U.Gudel, and Markus P.Hehlen

TE Radiative lifetime measurement of the a{^3}{SIGMA}{^+}
   metastable state of NO{^+} using a new type of electrostatic ion
   trap
AU R.Wester, K.G.Bhushan, N.Alstein, D.Zajfman, O.Heber,
   and M.L.Rappaport

TE Chlorine atom formation dynamics in the dissociaion of
   CH{_3}CF{_2}Cl (HCFC-142b) after UV laser photoxcitation
AU Richard A.Brownsword, Patricia Schmiechen, Hans-Robert Volpp,
   Hari P.Upadhyaya, Young Jae Jung, and Kyung-Hoon Jung

TE Measurement of the HD(v'=2,J'=3) product differential cross
   section for the H + D{_2} exchange reaction at 1.55 + 0.05 eV
   using the photoloc technique
AU Felix Fernandez-Alonso, Brian D.Bean, and Richard N.Zare

TE Raman study of the trans-gauche conformational equiluibrium of
   1,2-dichloroethane in water: Experimental evidence for the
   hydrophobic effect
AU Minoru Kato, Isao Abe, and Yoshihiro Taniguchi

TE An ab initio potential energy surface for Ne-CO
AU George C.McBane and Slawomir M.Cybulski

TE State to state Ne-CO rotationally inelastic scattering
AU Stiliana Antonova, Ao Lin, Antonis P.Tsakotellis,
   and George C.McBane

TE The photodissociation dynamics of CFBr excited into the
   A{^~}({^1}A") state
AU Pamela T.Knepp and Scott H.Kable

TE Orientation of pyrimidine in the gas phase using a strong
   electron field: Spectroscopy and relaxtion dynamics
AU Karen J.Franks, Hongzhi Li, and Wei Kong

TE Quantum molecular dynamics calculations and expeimental Raman
   spectra confirm the proposed strucure of the odd-numbered
   dimeric fullerene C{_119}
AU Sergei Lebedkin, Hermann Rietschel, Gary B.Adams, John B.Page,
   William E.Hull, Frank H.Hennrich, H.-J.Eisler, M.M.Kappes,
   and Wolfgang Kratschmer

TE Infrared spectrum and ab initio calculations of the
   CH{_3}CNH{^+} - H{_2} ionic complex
AU Otto Dopfer, Doris Roth, Rouslan V.Olkhov and John P.Maier

TE Perturbation theory approach to tunneling: Direct and resonance
   transmission in super-exchange models
AU Misha Galperin, Dvira Segal, and Abraham Nitzan

TE Compton profile study of bonding in BeO
AU K.B.Joshi, Rajesh Jain, R.K.Pandya, B.L.Ahuja, and B.K.Sharma

TE A new method for simulating the late stages of island coarsening
   in thin film growth: The role of island diffusion and evaporation
AU Thomas R.Mattsson, Greg Mills, and Horia Metiu

TE Photodissociation dynamics of acetylacetone: The OH product
   state distribution
AU Min-Chul Yoon, Young S.Choi, and Sang Kyu Kim

TE Vibrational levels and statistical analysis of the
   X({^1}{1/2}{_g}{^+}) ground state of CS{_2}
AU G.Brasen and W.Demtroder

TE The rotational spectrum of chloryl chloride, ClClO{_2}, in its
   ground vibrational state
AU Holger S.P.Muller, Edward A.Cohen, and Dines Christen

TE Photofragmentation spectroscopy of Al{^+} (C{_2}H{_4})
AU J.Chen.T.-H.Wong, P.D.Kleiber, and K.-H.Yang

TE Vibration-rotation emission spectra and combined isoopomer
   analyses for the coinage metal hydrides: CuH and CuD, AgH and
   AgD, and AuH and AuD
AU Jenning Y.Seto, Zulfikar Morbi, Frank Charron, Sang K.Lee,
   Peter F.Bernath, and Robert J.Le Roy

TE Theory of laser cooling of polyatomic molecules in an
   electronically excited state
AU Hicham Wadi and Eli Pollak

TE The {^57}Fe NMR shielding in ferrocene revisited. A
   density-functional study of shielding mechanisms and the
   influence of the exchange-correlation functional
AU Georg Schreckenbach

TE Calculation of frequency-dependent first hyperpolarizabilities
   using the second-order Mollerlesset perturbation theory
AU Takao Kobayashi, Kotoku Sasagane, Fumihiko Aiga,
   and Kizashi Yamaguchi

TE Ab initio study of the n-{pi}* electronic transition in acetone:
   Symmetry-forbidden vibronic spectra
AU D.W.Liao, A.M.Mebel, M.Hayashi, Y.J.Shiu, Y.T.Chen, and S.H.Lin

TE Perturbatively selected CI as an optimal source for externally
   corrected CCSD
AU G.Peris, J.Planelles, J.-P.Malrieu, and J.Paldus

TE Quantum Monte Carlo study of the dipole moment of CO
AU F.Schautz and H.-J.Flad

TE Trihydrogen cation solvated by rare gas atoms: Rg{_n}H{_3}{^+}
AU Martin Beyer, Elena V.Savchenko, and Vladimir E.Bondybey

TE Anions made of cations and dianions: [CsC{_9}]{^-} and
   [CsC{_7}]{^-}
AU A.Dreuw and L.S.Cederbaum

TE Localized and extended electronic eigenstates in proteins: A
   tight -binding approach
AU Thorsten Koslowski

TE Basis set superposition error-counterpoise corrected potential
   energy surfaces. Application to hydrogen peroxide...X (X =
   F{^-}, Cl{^-}, Br{^-}, Li{^+}, Na{^+}) complexes
AU Martha C.Daza, J.A.Dobado, Jose Molina Molina, Pedro Salvador,
   Miquel Duran, and Jose Luis Villaveces Cardoso

TE Scratching the surface of the water dication
AU Timothy J.Van Huis, Steven S.Wesolowski, Yukio Yamaguchi,
   and Henry F.Schaefer III

TE Ab initio and molecular dynamics studies on rare gas hydrides:
   Potential energy curves, isotropic hyperfine properties, and
   matrix cage trapping of atomic hydrogen
AU Toni Kiljunen, Jussi Eloranta, and Henrik Kunttu

TE Effects of basis set and electron correlation on the calculated
   interaction energies of hydrogen bonding complexes: MP2/cc-pV5Z
   calculations of H{_2}O-MeOH, H{_2}O-Me{_2}O, H{_2}O-H{_2}CO,
   MeOH-MeOH and HCOOH-HCOOH complexes
AU Seiji Tsuzuki, Tadafumi Uchimaru, Kazunari Matsumura,
   Masuhiro Mikami, and Kazutoshi Tanabe

TE A search for quadrupole-bound anions. I.
AU Gennady L.Gutsev, Puru Jena, and Rodney J.Bartlett

TE The quartet and sextet states of CS{^-}
AU M.Hochlaf, G.Chambaud, P.Rosmus, and T.Andersen

TE The ground state benzene-argon intermolecular potential energy
   surface
AU Henrik Koch, Berta Fernandez, and Jan Makrewicz

TE A combined quantum mechanics and molecular dynamics study of
   small Jahn-Teller distorted hydrocarbons: Another difficult test
   for density-functional theory
AU Stacey D.Wetmore, Russell J.Boyd, Leif A.Eriksson,
   and Aatto Laaksonen

TE Hydrogen bond and cooperative effect in the reactions of HOCl
   with HCl on water clusters
AU Si Chuan Xu

TE The Re{_6}Se{_8}Cl{_6}{^4-} and Re{_6}Se{_8}I{_6}{^4-} cluster
   ions. Another example of luminescent clusters?
AU Ramiro Arratia-Perez and Lucia Hernandez-Acevedo

TE Critical conditions for stable dipole-bound dianions
AU Cecilia Sarasola, Joseph E.Fowler, and Jesus M.Ugalde

TE Theoretical studies of CH{_4}(H{_2}O){_20}, (H{_2}O){_21},
   (H{_2}O){_20} and fused dodecahedral and tetraaidecahedral
   structures: How do natural gas hydrates form?
AU Arshad Khan

TE Femtosecond pump-probe study of molecular vibronic structures
   and dynamics of a cyanine dye in solution
AU T.-S.Yang, M.-S.Chang, R.Chang, M.Hayashi, S.H.Lin,
   P.Voehringer, W.Dietz, and N.F.Scherer

TE Polymer chain dynamics in dilute solution under Couette flow:
   Behavior of poly({alpha}-methylstyrene) in good solvent
AU Yoshisuke Tsunashima

TE Polymers simulated with an improved 'rebound selection'
AU Z.Alexandrowicz

TE An investigation of the shape and crossover scalng of flexible
   tangent hard-sphere polymer chains by Monte Carlo simulation
AU Andrew J.Haslam, George Jackson, and Tom C.B.McLeish

TE Tracing coexistence lines in multicomponent fluid mixtures by
   molecular simulation
AU Fernando A.Escobedo

TE Rate constants of spherical dispersions: From diffusion-limited
   data to non-diffusion limited results
AU Shih-Yuan Lu

TE Ensemble dependence of confined hard-rod fluids
AU Soon-Chul Kim

TE An ab initio analysis of medium perturbation on molecular
   polarizabilities
AU Akihiro Morita and Shigeki Kato

TE A simple model of tracer-diffusion of non-spherical Brownian
   particles
AU F.de J.Guevara-Rodriguez and M.Medina-Noyola

TE Intermediate-time tracer-diffusion of non-spherical Brownian
   particles
AU F.de J.Guevara-Rodriguez and M.Medina-Noyola

TE Monte Carlo simulations of smectic phase transiions in
   flexible-rigid-flexible molecules
AU Alison Casey and Peter Harrowell

TE Monte Carlo study of the phase structure of compact polymer
   chains
AU Anders Irbaeck and Erik Sandelin

TE Molecular polarisation in water chains
AU Kersti Hermansson and Maria Alfredsson

TE Lattice vibrations and thermodynamic stability of polymerized
   C{_60} deduced from heat capacities
AU Akira Inaba, Takasuke Matsuo, Ake Fransson, and Bertil Sundqvist

TE Molecular theory of thermomechanical coupling in cholesteric
   liquid crystals
AU Sten Sarman

TE Random walks with nearest neighbors prohibited on the diamond
   lattice
AU Vladimir Tchijov and Suemi Rodriguez-Romo

TE Comparison of structural properties of different polymer network
   types as obtained by computer simulation
AU Stefan Lay, Jens-Uwe Sommer, and Alexander Blumen

TE The equation of state of supercritical HF, HCl, and reactive
   supercritical mixtures containing the elements H, C, F, and Cl
AU Laurence E.Fried and W.Michael Howard

TE Angular distributions of Ar reflected from molten metal surfaces
AU A.Muis and J.R.Manson

TE A molecular dynamics simluation study of water on NaCl(100)
   using a polarizable water model
AU Elmar Stockelmann and Reinhard Hentschke

TE Fractal behavior of galvanic current of dual electrode type of
   atmospheric corrosion monitor
AU M.Saitou, W.Oshikawa, S.Itomura, and S.Tsuzikawa

TE Optical spectra and thermal Schottky levels in dysprosium
   sesquisulfide
AU John B.Gruber, Bahram Zandi, Bruce Justice, and Edgar F.Westrum,
   Jr.

TE Adsorption of water on NaCl(001). I. Interolecular potentials
   and low temperature structures
AU Ola Engkvist and Anthony J.Stone

TE Studies on electronic structures of semiconuctors by atomic
   force microscopy
AU Masaaki Shimizu, Hiroyuki Watanabe, Kazunori Anazawa,
   Tomoko Miyahara, and Chikara Manabe

TE Modeling analysis of molecular chiral effect detected by
   Maxwell-displacement-current measrements
AU Zhao Wei, Chen-Xu Wu, Mitsumasa Iwamoto, and Ou-Yan Zhong-can

TE NO monomer and (NO){_x} polymeric chain chemisorpion on Pt{110}:
   Structure and energetics
AU Q.Ge, W.A.Brown, R.K.Sharma, and D.A.King