Chemical Physics, 2000, V 254, N 2-3, 1 April.

 Hilaire Chevreau, Elise Boullant, Christine Dézarnaud-Dandine and
 Alain Sevin
A theoretical exploratory study of low-energy (1-2 eV)
electron catalysis in the CO2+H2[->]HCOOH gas phase process  
99-108

 Alba García-Muruais, Enrique M. Cabaleiro-Lago, Jose M.
 Hermida-Ramón and Miguel A. Ríos
The study of A(CH3OH)1-6 (A = Li+, Na+) in the gas phase
based on ab initio calculations, analysis of the solvation   
process
109-123

 Yordanka Dimitrova and Sigrid Peyerimhoff
Ab initio study of structures of hydrogen-bonded nitric acid
complexes    
125-134

 J. Spanget-Larsen, E.W. Thulstrup and J. Waluk
Electronic states of diphenyl- and dipyridyl-s-tetrazines:
linear and magnetic circular dichroism, and quantum chemical
calculations 
135-149

 Vi[\mbox{\v{s}}]nja Stepani[\mbox{\'{c}}] and Goran Baranovi
 [\mbox{\'{c}}]
Ground and excited states of isodiazene - an ab initio study 
151-168

 A.V. Fedorov and D.L. Snavely
Direct correlation method for OH, NH and CH local modes:
vibrational overtone spectroscopy of biphenyl, anthracene,
isobutanol, 2-chloroethanol and ethylenediamine at the third 
overtone region
169-179

 Ioannis D. Petsalakis and G. Theodorakopoulos
Electronic states of CF+
 181-186

 Claudia Zanchini
Silylcyanides and silylisocyanides: a comparative theoretical
study  
187-202

 B. Balta and F.A. Gianturco
Structural properties and quantum effects in protonated
helium clusters. I. The ab initio interaction potential
203-213

 B. Balta, F.A. Gianturco and F. Paesani
Structural properties and quantum effects in protonated
helium clusters. II. Quantum Monte Carlo calculations for the
smaller aggregates 
215-229

 Luning Zhang, Xuefeng Wang, Mohua Chen and Qi-Zong Qin
Activation of CO2 by Zr atom. Matrix-isolation FTIR
spectroscopy and density functional studies
231-238

 Stoyan Karabunarliev and Martin Baumgarten
Using antiferromagnetic couplers for high-spin ground states
in ion radicals    
239-247

 M.V. Vener, I.V. Rostov, A.V. Soudackov and M.V. Basilevsky
Semiempirical modeling free energy surfaces for proton
transfer in polar aprotic solvents   
249-265

 Lahouari Krim, Christophe Prot, Esmaďl M. Alikhani and Laurent
 Manceron
Reactions of ground state Ti atoms with NO: insertion versus
complexation. An IR matrix isolation study 
267-274

 J.J. Borras-Almenar, J.M. Clemente-Juan, E. Coronado, A.V. Palii
 and B.S. Tsukerblat
Anisotropic double exchange in orbitally degenerate mixed
valence systems    
275-285

 Xiao-Lei Zhu, Xiao-Zeng You and Yong Zhang
A novel approach to calculation of the second-order nonlinear
optical susceptibilities of organic crystals based on
energy-band theory 
287-296

 X. Bruet, J. Bonamy and M.L. Dubernet-Tuckey
Broadening and shifting coefficients of Raman isotropic
Q(j)(j=0,1,2) lines for pure H2: coupled states and
semiclassical calculations.
297-307

 Runjun Li, Agnes Derecskei-Kovacs and Simon W. North
The unimolecular dissociation of 2-butenenitrile:
measurements of the CN elimination channel using FM Doppler
spectroscopy 
309-317

 W. Humbs, H. Zhang and M. Glasbeek
Femtosecond fluorescence upconversion spectroscopy of
vapor-deposited tris(8-hydroxyquinoline) aluminum films
319-327

 Manuel Galán and Gonzalo Angulo
Some remarks on the application of relaxation techniques to
chemical equilibria
329-336

 A. Morresi, P. Sassi, M. Paolantoni, S. Santini and R.S.
 Cataliotti
Solvent effect on the vibrational dephasing of the [nu]2 (CN)
and [nu]4 (CC) stretching modes in liquid acetonitrile and   
acetonitrile-d3
337-347

 M. Schmitt, J. Küpper, D. Spangenberg and A. Westphal
Determination of the structures and barriers to hindered
internal rotation of the phenol-methanol cluster in the S0
and S1 states
349-361

 H. Gratz and A. Penzkofer
Singlet-singlet excited-state absorption and triplet-triplet
absorption of meso-tetraphenylporphine     
363-374

 V. Galasso, D. Jones, A. Modelli and M.L. Trudell
A study of the molecular structure and spectroscopic
properties of benzo- and pyrido-tetraazapentalenes     
375-383

 A.W. Potts et al.
An experimental and theoretical study of the valence shell
photoelectron spectrum of the chlorobenzene molecule   
385-405

 B. Bliß, U. Lommatzsch, C. Monte, W. Rettig and B. Brutschy
Supersonic jet and solution studies of intramolecular
complexes with TICT formation mimicking solute-solvent
interaction  
407-420

Index
421-425

Index
427-438