Chemical Physics Letters, 1999, V 314, N 3-4, 3 December.
Y. Joseph, C. Kuhrs, W. Ranke, M. Ritter and W. Weiss
Adsorption of water on FeO(111) and Fe3O4(111):
identification of active sites for dissociation
195-202
akir Erkoç Turgut Batu, Masaru Hirata and Shoichi Tachimori
Energetics and structural stability of lanthanum microclusters
203-209
Shin-ichi Ohkoshi and Kazuhito Hashimoto
Ferromagnetism of cobalt-chromium polycyanides
210-214
Rouslan V. Olkhov and Otto Dopfer
Spectroscopic and ab initio studies of ionic hydrogen bonds:
the O-H stretch vibration of SiOH+-X dimers
(X=He, Ne, Ar, N2)
215-222
Qiang Fu, Chuan-Bao Cao and He-Sun Zhu
A solvothermal synthetic route to prepare polycrystalline carbon nitride
223-226
Wim Bouwen et al.
Stability effects of AunXm+
(X=Cu, Al, Y, In) clusters
227-233
Venelin Enchev, Snezhana Bakalova, Galya Ivanova and Neyko Stoyanov
Excited state intramolecular proton transfer in 2-acetylindan-1,3-dione
234-238
J.T. Rasmussen, M. Hohwy, H.J. Jakobsen and N.C. Nielsen
Magnitude and absolute orientation of 1H chemical shielding
tensors in polycrystalline powders: a 1H CRAMPS NMR study of
KH2PO4
239-245
Steven G. Mayer, Carsten L. Thomsen, Matthew P. Philpott and Philip J. Reid
The solvent-dependent isomerization dynamics of 4-(dimethylamino)azobenzene
(DMAAB) studied by subpicosecond pump-probe spectroscopy
246-254
R. Lécuiller, J. Berréhar, C. Lapersonne-Meyer,
M. Schott and J.-D. Ganière
Fluorescence quantum yield and lifetime of `red' polydiacetylene
chains isolated in their crystalline monomer matrix
255-260
Ji-ichiro Hashimoto, Katsunori Segawa and Hirochika Sakuragi
Effects of a sulfur substituent on the behavior and generation
mode of aroyloxyl radicals in the photolysis of diaroyl peroxides
261-266
Hironobu Umemoto
14/15N isotope effect in the UV photodissociation
of N2O
267-272
Michael Hippler and Martin Quack
Cw cavity ring-down infrared absorption spectroscopy in pulsed
supersonic jets: nitrous oxide and methane
273-281
K. Bhanuprakash and J. Laxmikanth Rao
Theoretical studies on the nonlinear optical properties of zwitterionic
organic molecules: effect of
--
through-bond coupling on the first hyperpolarizability
282-290
So Hirata and Martin Head-Gordon
Time-dependent density functional theory within the Tamm-Dancoff approximation
291-299
Wen-Guo Xu, Guo-Liang Li, Li-Jie Wang, Se Li and Qian-Shu Li
Ab initio and density functional theory study of the mechanism of
synthesis of the N5+ cation
300-306
O. Kullie, C. Düsterhöft and D. Kolb
Dirac-Fock finite element method (FEM) calculations for some diatomic
molecules
307-310
Paul M. Mayer
Binding energies of nitrile-containing proton-bound clusters: the
performance of HF, MP2 and B3-LYP vs. G2
311-316
Z.F. Liu, C.K. Siu and John S. Tse
Ab initio molecular dynamics study on the thermal dissociation of
acetic acid
317-325
Micha Rode, Joanna Sadlej, Robert Moszynski, Paul E.S. Wormer and
Ad van der Avoird
The importance of high-order correlation effects for the CO-CO
interaction potential
326-332
Szczepan Roszak and Jerzy Leszczynski
The structures, thermodynamics, and nature of interactions of
silanium cations shellvated by molecular hydrogen,
SiH3+(H2)n (n=1-11)
333-340
Jaron C. Hansen, Yumin Li, Zhuangjie Li and Joseph S. Francisco
On the mechanism of the BrO+HBr reaction
341-346
Antara Dutta, Joydeep Bhattacharjee and Kalyan Kumar Das
A30+-X1>+0+
and B31-X1
+0+ transitions of GaI: an MRDCI study
347-352
Eugene S. Kryachko
Ab initio studies of the conformations of water hexamer:
modelling the penta-coordinated hydrogen-bonded pattern in liquid water
353-363
Yoshiaki Amatatsu
Ab initio study on the electronic structures of stilbene at the
conical intersection
364-368
Toshimasa Ishida and George C. Schatz
A local interpolation scheme using no derivatives in quantum-chemical
calculations
369-375
N.J.B. Green and S.H. Robertson
Diffusion equation coefficients for gas-phase energy transfer
376-380
S. Ajith Perera and Rodney J. Bartlett
Coupled-cluster calculations of Raman intensities and their
application to N4 and N5
381-387