Chemical Physics Letters, 1999, V 311, N 1-2, 17 September.
Andreas Eichler, Jürgen Hafner, Axel Groß, Matthias Scheffler,
Rotational effects in the dissociation of H2 on metal
surfaces studied by ab initio quantum-dynamics calculations,
pp. 1-7
D. Zerulla, D. Mayer, K.H. Hallmeier, T. Chassé,
Angular-resolved XANES measurements of the polar and azimuthal orientation of
alkanethiols on InP(110),
pp. 8-12
M. Saß, J. Löbau, M. Lettenberger, A. Laubereau,
Vibrational energy transfer of chemisorbed ethyltrichlorosilane at
the glass/air interface,
pp. 13-20
Ihsan Boustani, Angel Rubio, Julio A. Alonso,
Ab initio study of B32 clusters: competition
between spherical, quasiplanar and tubular isomers,
pp. 21-28
Jerzy Sepiol, Alexander Starukhin, Robert Kolos, Tatiana Latychevskaia,
Jan Jasny, Alois Renn, Urs P. Wild,
Detection and spectroscopy of single molecules in rare gas matrices:
dibenzanthanthrene in krypton and xenon,
pp. 29-35
Sang Kuk Lee, Dae Youl Baek,
Visible vibronic emission spectrum of the jet-cooled pentafluorobenzyl radical,
pp. 36-40
U. Hofmann, A. Schreiber, D. Haarer, S.J. Zilker, A. Bacher, D.D.C. Bradley,
M. Redecker, M. Inbasekaran, W.W. Wu, E.P. Woo,
Investigations on the grating dynamics in a fast photorefractive
guest--host polymer,
pp. 41-46
Esa Isoniemi, Leonid Khriachtchev, Mika Pettersson, Markku Räsänen,
Infrared spectroscopy and 266 nm photolysis of H2S2 in solid Ar,
pp. 47-54
Swadeshmukul Santra, G. Krishnamoorthy, Sneh K. Dogra,
Excited state intramolecular proton transfer in 2-(2'-benzamidophenyl)
benzimidazole: effect of solvents,
pp. 55-61
C. Majumder, S.K. Kulshreshtha, G.P. Das, D.G. Kanhere,
Clustering behaviour in bimetallic clusters: a density functional
theory based molecular dynamics study,
pp. 62-68
Massimiliano Bienati, Carlo Adamo, Vincenzo Barone,
Performance of a new hybrid Hartree--Fock/Kohn--Sham model (B98) in
predicting vibrational frequencies, polarisabilities and NMR chemical shifts,
pp. 69-76
Sne{zˇ}ana D. Zari{c´}, Cation--π interaction with
transition-metal complex as cation,
pp. 77-80
Yu.A. Abramov, A.V. Volkov, P. Coppens,
On the evaluation of molecular dipole moments from multipole
refinement of X-ray diffraction data,
pp. 81-86
Tomasz Adam Wesolowski,
Application of the DFT-based embedding scheme using an explicit
functional of the kinetic energy to determine the spin density
of Mg+ embedded in Ne and Ar matrices,
pp. 87-92
Z.F. Liu, C.K. Siu, John S. Tse,
Ab initio molecular dynamics study on the hydrolysis of molecular chlorine,
pp. 93-101