The Journal of Chemical Physics, 2001, V 115, N 14, October 8.
TE Ion imaging measurement of collision-induced rotational
alignment in Ar-NO scattering
AU Joseph I.Cline, K.Thomas Lorenz, Elisabeth A.Wade, James W.Barr,
and David W.Chandler
PP 6277-6280
TE Pump-probe polarization anisotropy study of doubly degenerate
electronic reorientation in silicon naphthalocyanine
AU Allison Albrecht Ferro and David M.Jonas
PP 6281-6284
TE On the generalized bulk viscosity behavior
AU D.Bertolini and A.Tani
PP 6285-6288
ARTICLES
TE On the calculation of entropy from covariance matrices of the
atomic fluctuations
AU Ioan Andricioaei and Martin Karplus
PP 6289-6292
TE Time-dependent Hartree-Fock schemes for analytical evaluation of
the Raman intensities
AU Olivier Quinet and Benoit Champagne
PP 6293-6299
TE Ground- and excited-state cusp conditions for the electron density
AU A.Nagy and K.D.Sen
PP 6300-6308
TE Quantum relaxation dynamics using Bohmian trajectories
AU Jeremy B.Maddox and Eric R.Bittner
PP 6309-6316
TE Generalized Filinov transformation of the semiclassical initial
value representation
AU Haobin Wang, David E.Manolopoulos, and William H.Miller
PP 6317-6326
TE Heats of formation of CCl and CCl_{2} from ab initio quantum
chemistry
AU David A.Dixon and Kirk A.Peterson
PP 6327-6329
TE A comprehensive thermodynamic theory of the Soret effect in a
multicomponent gas, liquid, or solid
AU L.J.T.M.Kempers
PP 6330-6341
TE A comprehensive thermodynamic theory of the cross-effect in isothermal
diffusion ("Hertz effect") in a multicomponent gas, liquid, or solid
AU L.J.T.M.Kempers
PP 6342-6350
TE Estimate of the cutoff errors in the Ewald summation for dipolar
systems
AU Zuowei Wang and Christian Holm
PP 6351-6359
TE Intrinsic bond strengths of multiple gallium-gallium bonds: A
compliance matrix study using multiconfiguration self-consistent
field wave functions and hybrid density functionals
AU Joerg Grunenberg
PP 6360-6364
TE Potential energy curves and dipole transition moments for
electronic states of ArHe and HeNe
AU Ioannis D.Petsalakis, Giannoula Theodorakopoulos,
Heinz-Peter Liebermann, and Robert J.Buenker
PP 6365-6372
TE Deprotonation energy of HO_{2}: Basis set limit energies
AU Joseph S.Francisco
PP 6373-6375
TE Structure and dynamics of I_{2}^{-}(N_{2}O)_{n}: Monte Carlo and
molecular dynamics simulations
AU Eunseog Cho and Seokmin Shin
PP 6376-6384
TE Spin-orbit branching in the collision-induced dissociation
reaction of He(^{1}S_{0})+HF(X ^{1}Sigma_{0}^{+})-->
He(^{1}S_{0})+H(^{2}S_{1/2})+F(^{2}P_{3/2,1/2})
AU Toshiyuki Takayanagi and Akira Wada
PP 6385-6393
TE Rotationally resolved infrared spectrum of the Br^{-}-D_{2}
anion complex
AU D.A.Wild, P.S.Weiser, and E.J.Bieske
PP 6394-6400
TE Ring closure in dioxin formation process: An ab initio molecular
dynamics study
AU Amir A.Farajian, Masuhiro Mikami, Pablo Ordejon, and Kazutoshi Tanabe
PP 6401-6405
TE Hydrogen bonding and collective proton modes in clusters and
periodic layers of squaric acid: A density functional study
AU Carme Rovira, Juan J.Novoa, and Pietro Ballone
PP 6406-6417
TE Dynamics of vibrationally mediated photodissociation of CH_{3}CFCl_{2}
AU Tina Einfeld, Christof Maul, Karl-Heinz Gericke, Ran Marom,
Salman Rosenwaks, and Ilana Bar
PP 6418-6425
TE Detailed study of pyridine at the C 1s and N 1s ionization
thresholds: The influence of the vibrational fine structure
AU C.Kolczewski, R.Puettner, O.Plashkevych, H.Agren, V.Staemmler,
M.Martins, G.Snell, A.S.Schlachter, M.Sant'Anna, G.Kaindl,
and L.G.M.Pettersson
PP 6426-6437
TE Dipole-allowed excited states of N_{2}: Potential energy curves,
vibrational analysis, and absorption intensities
AU Dirk Spelsberg and Wilfried Meyer
PP 6438-6449
TE Split operator method for the nonadiabatic (J=0) bound states
and (A<--X) absorption spectrum of NO_{2}
AU V.N.Serov, V.B.Sovkov, V.S.Ivanov, and O.Atabek
PP 6450-6458
TE Rotational spectroscopy of IO X ^{2}Pi_{i}
AU Charles E.Miller and Edward A.Cohen
PP 6459-6470
TE Potential energy curves and transport properties for the
interaction of He with other ground-state atoms
AU Harry Partridge, James R.Stallcop, and Eugene Levin
PP 6471-6488
TE Temporary anion states of selected amino acids
AU K.Aflatooni, B.Hitt, G.A.Gallup, and P.D.Burrow
PP 6489-6494
TE Rate coefficients for the reactions of Si(^{3}P_{J}) with
C_{2}H_{2} and C_{2}H_{4}: Experimental results down to 15 K
AU A.Canosa, S.D.Le Picard, S.Gougeon, C.Rebrion-Rowe, D.Travers, and B.R.Rowe
PP 6495-6503
TE Investigation of the Ne-NH_{3} van der Waals complex: Rotational
spectrum and ab initio calculations
AU Jennifer van Wijngaarden and Wolfgang Jaeger
PP 6504-6512
TE Observation of CH_{4} (v_{2}=1 or v_{4}=1) in the reaction
Cl+CH_{4} with time-resolved Fourier-transform infrared
absorption spectroscopy
AU Yu-Ju Chen, Li-Kung Chu, Shiaw-Ruey Lin, and Yuan-Pern Lee
PP 6513-6521
TE Specific rate constants k(E,J) for the dissociation of NO_{2}.
I. Time-resolved study of rotational dependencies
AU B.Abel, B.Kirmse, J.Troe, and D.Schwarzer
PP 6522-6530
TE Specific rate constants k(E,J) for the dissociation of NO_{2}.
II. Linewidths of rotationally selected NO_{2} near to the
dissociation threshold
AU B.Abel, N.Lange, and J.Troe
PP 6531-6537
TE Freezing of hard spheres in confinement
AU Willem K.Kegel
PP 6538-6549
TE Reaction path for hydrogen adsorption and desorption on Si(100)-(2x1)
AU E.S.Tok and H.Chuan Kang
PP 6550-6556
TE The asymptotic decay of pair correlations in the path-integral
quantum hard-sphere fluid
AU Lorna E.Bailey and Luis M.Sese
PP 6557-6568
TE H-bonding in amorphous acetamide CH_{3}CONH_{2} as studied by
x-ray scattering
AU Salah Nasr
PP 6569-6577
TE Polarization interactions and boroxol ring formation in boron
oxide: A molecular dynamics study
AU Janna K.Maranas, Yingzi Chen, Dorothea K.Stillinger,
and Frank H.Stillinger
PP 6578-6589
TE Stochastic resonance with explicit internal signal
AU Qian Shu Li and Rui Zhu
PP 6590-6595
TE Structure and stability of endohedral fullerene Sc_{3}N@C_{80}:
A Raman, infrared, and theoretical analysis
AU M.Krause, H.Kuzmany, P.Georgi, L.Dunsch, K.Vietze, and G.Seifert
PP 6596-6605
TE Two-dimensional Fourier transform electronic spectroscopy
AU John D.Hybl, Allison Albrecht Ferro, and David M.Jonas
PP 6606-6622
TE Corresponding states law and molecular dynamics simulations of
the Lennard-Jones fluid
AU D.O.Dunikov, S.P.Malyshenko, and V.V.Zhakhovskii
PP 6623-6631
TE Temperature evolution of the translational density of states of
liquid water
AU Alberto De Santis, Alessandro Ercoli, and Dario Rocca
PP 6632-6640
TE Multidensity integral equation theory for a sticky hard
sphere-hard sphere heteronuclear dimer fluid: Thermodynamic and
structural properties
AU Ning Wu and Y.C.Chiew
PP 6641-6652
TE Integral equations for molecular fluids based on the interaction
site model: Density-functional formulation
AU Tomonari Sumi, Takashi Imai, and Fumio Hirata
PP 6653-6662
TE Interpretation of the molten BeF_{2} viscosity anomaly in terms
of a high temperature density maximum, and other waterlike features
AU Mahin Hemmati, Cornelius T.Moynihan, and C.Austen Angell
PP 6663-6671
TE Following transformation in self-assembled alkanethiol
monolayers on Au(111) by in situ scanning tunneling microscopy
AU C.Vericat, G.Andreasen, M.E.Vela, H.Martin, and R.C.Salvarezza
PP 6672-6678
TE Classical interatomic potentials for Si-O-F and Si-O-Cl systems
AU H.Ohta and S.Hamaguchi
PP 6679-6690
TE Optimization of Xe adsorption kinetics in single walled carbon
nanotubes
AU A.Kuznetsova, J.T.Yates, Jr., V.V.Simonyan, J.K.Johnson,
C.B.Huffman, and R.E.Smalley
PP 6691-6698
TE Distribution kinetics theory of Ostwald ripening
AU Giridhar Madras and Benjamin J.McCoy
PP 6699-6706
TE Application of classical models of chirality to surface second
harmonic generation
AU F.Hache, H.Mesnil, and M.C.Schanne-Klein
PP 6707-6715
TE The charge of glass and silica surfaces
AU Sven H.Behrens and David G.Grier
PP 6716-6721
TE Specular x-ray reflectivity study of ordering in self-assembled
organic and hybrid organic-inorganic electro-optic multiplayer films
AU G.Evmenenko, M.E.van der Boom, J.Kmetko, S.W.Dugan, T.J.Marks,
and P.Dutta
PP 6722-6727
TE Experimental and simulation studies on the transport of gaseous
diatomic molecules in polycarbonate membranes
AU Mar Lopez-Gonzalez, Enrique Saiz, Julio Guzman, and Evaristo Riande
PP 6728-6736
TE Effects of conformational isomerism on the desorption kinetics
of n-alkanes from graphite
AU Kris R.Paserba and Andrew J.Gellman
PP 6737-6751
TE Diameter control of single-walled carbon nanotubes using
argon-helium mixture gases
AU Samir Farhat, Marc Lamy de La Chapelle, Annick Loiseau,
Carl D.Scott, Serge Lefrant, Catherine Journet, and Patrick Bernier
PP 6752-6759
TE Effect of field-dependent photogeneration on the rate of grating
formation in photorefractive polymers
AU D.J.Binks and D.P.West
PP 6760-6765
TE Analysis of the sign reversal of the second-order molecular
polarizability in polymethineimine chains
AU Denis Jacquemin, David Beljonne, Benoit Champagne,
Victor Geskin, Jean-Luc Bredas, and Jean-Marie Andre
PP 6766-6774
TE Amphiphile-rich phase in a model ternary solution on the
honeycomb lattice
AU Dale A.Huckaby, Andrzej Pekalski, Daniela Buzatu, and Florin D.Buzatu
PP 6775-6779
TE Third-order nonlinear optical properties of fractal- and
nonfractal-structured oligomers modeled after dendron parts in
Cayley-tree-type dendrimers
AU Masayoshi Nakano, Harunori Fujita, Masahiro Takahata,
and Kizashi Yamaguchi
PP 6780-6784
TE Dynamics of inhomogeneous cross-linked polymers consisting of
domains of different sizes
AU A.A.Gurtovenko and Yu.Ya.Gotlib
PP 6785-6793
LETTERS TO THE EDITOR
TE Comment on "High order finite difference algorithms for solving
the Schroedinger equation in molecular dynamics" [J. Chem.
Phys., v.111, 10827 (1999)]
AU David A.Mazziotti
PP 6794-6795
TE Response to "Comment on `High order finite difference algorithms
for solving the Schroedinger equation in molecular dynamics'"
[J. Chem. Phys., v.115, 6794 (2001)]
AU Raul Guantes and Stavros C.Farantos
PP 6796-6797
TE Erratum: "Microcalorimetric measurements of the heat of
adsorption of Pb on well-defined oxides: MgO(100) and
p(2x1)-oxide on Mo(100)" [J. Chem. Phys., v.114, 3752 (2001)]
AU D.E.Starr, D.J.Bald, J.E.Musgrove, J.T.Ranney, and C.T.Campbell
PP 6798