Chemical Physics Letters, 2001, V 344, N 1-2, 17 August.

G. Janssens et al.
Chemical structure, aggregate structure and optical properties of adsorbed dye 
molecules investigated by scanning tunnelling microscopy
1-6

S. Mezhenny, I. Lyubinetsky, W.J. Choyke, R.A. Wolkow and J.T. Yates Jr.
Multiple bonding structures of C2H2 chemisorbed on Si(100)

7-12

Anyuan Cao, Cailu Xu, Ji Liang, Dehai Wu and Bingqing Wei
X-ray diffraction characterization on the alignment degree of carbon nanotubes
13-17

Tak Jeong, Wan-Young Kim and Yoon-Bong Hahn
A new purification method of single-wall carbon nanotubes using H2S and O2 
mixture gas
18-22

Scott Davis, Michal Farnik, Dairene Uy and David J. Nesbitt
Concentration modulation spectroscopy with a pulsed slit supersonic discharge 
expansion source
23-30

T. Rajh et al.
Spin polarization mechanisms in early stages of photoinduced charge separation 
in surface-modified TiO2 nanoparticles
31-39

R. Amutha, V. Subramanian and Balachandran Unni Nair
Interaction of benzidine with DNA: experimental and modelling studies
40-48

Alejandro Bussandri and Hans van Willigen
Observation of radical pair zero quantum coherence effects in the FT-EPR spectra 
of SO3 and eaq generated by photoionization of sulfite ions
49-54

Andreas Bloe?, Yannig Durand, Michio Matsushita, Jan Schmidt and Edgar J.J. 
Groenen
A single-molecule study of the relation between the resonance frequency and the 
orientation of a guest molecule in a Shpol'skii system
55-60

M.B. Williams, P. Campuzano-Jost, D. Bauer and A.J. Hynes
Kinetic and mechanistic studies of the OH-initiated oxidation of dimethylsulfide 
at low temperature - A reevaluation of the rate coefficient and branching ratio
61-67

Giancarlo Antonioli, Deborah E. McMillan and Paul Hodgkinson
Line-splitting and broadening effects from 19F in the 13CNMR of liquid crystals 
and solids
68-74

J.M. Thompsen and L.M. Ziurys
Transition metal sulfide studies: the pure rotational spectrum of the CuS 
radical (X2i)
75-84

T. Nakanaga and F. Ito
Infrared predissociation reaction of the hydrogen bonds in the ternary cluster 
cation of aniline-water-benzene+
85-91

M. Osiac, J. Ropcke and P.B. Davies
Infrared laser spectrum of the fundamental band of the boron monoxide free 
radical
92-96

J.Q. Hu et al.
Characterization of zinc oxide crystal whiskers grown by thermal evaporation
97-100

P.W. Deutsch, L.A. Curtiss and J.-P. Blaudeau
Electron affinities of germanium anion clusters, Gen (n=2-5)
101-106

M.E. Martin, M.A. Aguilar, S. Chalmet and M. Ruiz-Lopez
A comparative study of two QM/MM methods testing the validity of the mean field 
approximation
107-112

M. Gerhards, A. Jansen, C. Unterberg and K. Kleinermanns
OH stretching vibrations of the phenol(H2O)1+ cation

113-119
Toshikatsu Koga
On the electron-electron coalescence function in Hartree-Fock theory
120-124

Vandana Kurkal and Stuart A. Rice
Sequential STIRAP-based control of the HCNCNH isomerization
125-137

Sukhendu Nath and Avinash V. Sapre
Photoinduced electron transfer from chloropromazine and promethazine to 
chloroalkanes accompanied by cleavage of C-Cl bond
138-146

Herve Jobic, Konstantin S. Smirnov and Daniel Bougeard
Inelastic neutron scattering spectra of zeolite frameworks - experiment and 
modeling
147-153

J. Karolczak et al.
The measurements of picosecond fluorescence lifetimes with high accuracy and 
subpicosecond precision
154-164

Karol Kowalski and Piotr Piecuch
A comparison of the renormalized and active-space coupled-cluster methods: 
Potential energy curves of BH and F2
165-175

Piotr Piecuch, Stanisaw A. Kucharski and Karol Kowalski
Can ordinary single-reference coupled-cluster methods describe the potential 
energy curve of N2? The renormalized CCSDT(Q) study
176-184

Ken Sakata, Noritsugu Kometani and Kimihiko Hara
Ab initio calculation of the torsional potential for 2-alkenylanthracene in the 
ground and excited states
185-192

Barbara Herrera and Alejandro Toro-Labbe
Theoretical study of the internal rotation of cubylcubane and cubylcubane 
difluoride
193-199

Yoshiaki Amatatsu
Ab initio study on the electronic structures of styrene at the conical 
intersection
200-206

Laura Gagliardi, Bernd Schimmelpfennig, Laurent Maron, Ulf Wahlgren and Andrew 
Willetts
Spin-orbit coupling within a two-component density functional theory approach: 
theory, implementation and first applications
207-212

Boggavarapu Kiran, Chris Vinckier and Minh Tho Nguyen
A Quantum chemical study on the potential energy surface of Mg(1S)+N2O reaction
213-220

Pablo A. Denis and Oscar N. Ventura
Density functional investigation of atmospheric sulfur chemistry II. The heat of 
formation of the XSO2 radicals X=H,CH3
221-228

G.N. Patwari, S. Wategaonkar and M. Durga Prasad
Franck-Condon spectral calculations on trans-hydroquinone
229-235

Michael V. Pak and Mark S. Gordon
The potential energy surfaces for AlO2 using multi-reference wave functions
236-240

Alexandros V. Prosmitis, Vassilis C. Papadimitriou, Josef Pola and Panos 
Papagiannakopoulos
Kinetic study for the reactions of chlorine atoms with hexamethyldisiloxane, 
1,1,3,3-tetramethyldisiloxane, and 1,3-dimethyldisiloxane
241-248