Chemical Physics Letters, 2002, V 356, N 1-2, 15 April.

Kazuo Toyota, Masahiro Ehara and Hiroshi Nakatsuji
Elimination of singularities in molecular orbital derivatives: minimum
orbital-deformation (MOD) method 
1-6

Wei-Quan Tian, Galina Orlova and John D. Goddard
Consequences of accidental degeneracy within density functional theory:
the enigmatic structure of boron nitrosyl 
7-13

Cecilia Coletti and Gert D. Billing
Vibrational energy transfer in molecular oxygen collisions 
14-22

G. Yalovega et al.
Geometric structure of (NaCl)4 clusters studied with XANES at the chlorine
L-edge and at the sodium K-edge 
23-28

V.A. Ermoshin, M. Erdmann and V. Engel
Fermi-Pasta-Ulam recurrences, normal modes and wave-packet revivals 
29-35

Chiranjib Majumder, Vijay Kumar, Hiroshi Mizuseki and Yoshiyuki Kawazoe
Ionization potentials of small tin clusters: first principles calculations 
36-42

J. Visser and E.J.J. Groenen
The fine-structure in the lowest triplet state of C60 and C70 
43-48

Thomas Gustavsson, Alexei Sharonov, Delphine Onidas and Dimitra Markovitsi
Adenine, deoxyadenosine and deoxyadenosine 5?-monophosphate studied by 
femtosecond fluorescence upconversion spectroscopy 
49-54

Yu.I. Sukharev, B.A. Markov and I.V. Antonenko
Circular autowave pacemakers in thin-layered zirconium oxyhydrate 
55-62

Jong Keun Park, Bong Gon Kim and In Sun Koo
Avoided curve crossings for the dissociation reaction of the Rydberg H3O
radical into (OH+H2) 
63-72

Ulla Gro Nielsen, J?rgen Skibsted and Hans J. Jakobsen
[beta] -VO2 [--] a V(IV) or a mixed-valence V(III)-V(V) oxide [--] studied by 
51V MAS NMR spectroscopy 
73-78

Helena Dodziuk and Grigory Dolgonos
Molecular modeling study of hydrogen storage in carbon nanotubes 
79-83

K. Sekiguchi, A. Shimojima and O. Kajimoto
Intramolecular and intermolecular vibrational energy relaxation of CH2I2 
dissolved in supercritical fluid 
84-90

H. Mahmoud, I.N. Germanenko, Y. Ibrahim and M.S. El-Shall
Spectroscopy and structure of styrene (water)n and styrene (methanol)n clusters, 
n=1,2 
91-100

Ping Lin et al.
A morphed ground state potential for Ne:HI based on microwave spectroscopy 
101-108

Mei-Fun Cheng, Ho-On Ho, Chow-Shing Lam and Wai-Kee Li
Heats of formation for the boron hydrides: a Gaussian-3 study 
109-119

J.F. Castillo, F.J. Aoiz and L. Ban~ares
A quasiclassical trajectory study of the H+H2O [->] OH+H2 reaction dynamics at 
1.4 eV collision energy on a new ab initio potential energy surface 
120-126

Geyser Ferna'ndez Cata', Germa'n Rojas Lorenzo, Jose' Antonio Odriozola and Luis 
Javier Alvarez
Charge-transfer molecular dynamics of aluminium nitride 
127-132

Nobuyuki Akai, Satoshi Kudoh, Masao Takayanagi and Munetaka Nakata
Cis-trans isomerization equilibrium in hydroquinone in low-temperature argon and 
xenon matrices studied by FTIR spectroscopy 
133-139

D.L. Cheung, S.J. Clark and M.R. Wilson
Calculation of the rotational viscosity of a nematic liquid crystal 
140-146

Javier Rodriguez, Gustavo Moriena and Daniel Laria
Dynamical pathways for isomerization processes in the water nonamer 
147-152

M. Stener
Photoionization of oriented molecules: a time dependent density functional 
approach 
153-160

Q.Y. Zhang, K. Pita, W. Ye, W.X. Que and C.H. Kam
Effects of composition and structure on spectral properties of Eu3+-doped 
yttrium silicate transparent nanocrystalline films by metallorganic 
decomposition method 
161-167

Mayra Ocasio and Gustavo E. Lo'pez
Solid-liquid phase diagram of the water octamer 
168-174

Na Sun et al.
Hexakisaddu ct C60-Ag nanocomposite: fabrication and optical limiting effect 
175-180

G. Eshchenko, T. Ko"cher, C. Kerst and F. Temps
Formation of HCNO and HCN in the 193 nm photolysis of H2CCO in the presence
of NO 
181-187

Erratum
N. Nilius, N. Ernst and H.-J. Freund
On energy transfer processes at cluster-oxide interfaces: silver on titania 
188