Chemical Physics, 1999, V 243, N1-2, 1 May.


Accurate Gaussian basis sets for second-row atoms and ions generated with the 
improved generator coordinate Hartree-Fock method
1 -- 7
E.V.R. de Castro, F.E. Jorge, J.C. Pinheiro
 
Inner-shell excitations of water molecule
9 -- 15
A.B. Rocha, C.E. Bielschowsky
  
Effect of protonation on the atomic and bond properties of 
the carbonyl group in aldehydes and ketones
17 -- 26
A.M. Grana, R.A. Mosquera
  
Water-catalyzed mechanism for the pyrolysis of formic acid
27 -- 34
W. Baoshan, H. Hua, G. Yueshu
  
Molecular orbital models of benzene, biphenyl and the oligophenylenes
35 -- 44
R.J. Bursill, W. Barford, H. Daly
  
Dual fluorescence of 2-(4_-N,N-dimethylaminophenyl)benzoxazole: 
effect of solvent and pH
45 -- 59
G. Krishnamoorthy, S.K. Dogra
  
X-ray absorption near-edge spectroscopy (XANES) at the 
phosphorus K-edge of triorganophosphinechalcogenides
61 -- 75
C. Engemann, R. Franke, J. Hormes, C. Lauterbach, E. Hartmann, J. Clade, M. Jansen
  
Calculation of the differential photoionization cross-section of PH3
77 -- 87
V. Carravetta, I. Cacelli

Photodissociation of some simple nitriles in the extreme vacuum ultraviolet region
89 -- 96
K. Kanda, T. Nagata, T. Ibuki
  
Coherent control of the molecular iodine vibrational dynamics by chirped 
femtosecond light pulses: theoretical simulation of the pump-probe experiment
97 -- 114
V.V. Lozovoy, O.M. Sarkisov, A.S. Vetchinkin, S.Ya. Umanskii

Chain-length dependence of the optical properties of a series of 
push-pull polyenes: application to doped photorefractive polymers
115 -- 121
A. Fort, J. Muller, L. Mager
  
Relaxation times of a dissipative two-state system for a 
resonance treatment.  Application to electron transfer reactions
123 -- 135
T. Cheche, S.H. Lin

Perturbation approach to depolarized Rayleigh band shape theory corrected 
for collision-induced coherence: applications to hydrogen and deuterium
137 -- 147
A.P. Kouzov, J.V. Buldyreva
  
  
Temperature dependence of fullerene electroabsorption spectra - model calculations
149 -- 157
P. Petelenz, M. Andrzejak, S. Kazaoui, N. Minami
  
Kinetic study of the electron transfer process between Ru(NH3)5pz2+ 
and S2O2?8 in water-cosolvent mixtures: 
a new component of reorganization energy
159 -- 168
F. Sanchez, A. Rodriguez, F. Muriel, J. Burgess, P. Lopez-Cornejo
 
Reducing quasi-ergodicity in Monte Carlo simulations of the plastic phase of the 
cyanoadamantane crystal
169 -- 177
B. Kuchta, M. Descamps, J.F. Willart
 
Structure and dynamics of helically twisted cyanine dyes
179 -- 188
S. Falzewski, F. Terstegen, V. Bu_
  
A field-cycling NMR relaxometry investigation of proton tunnelling in a 
partially disordered system of hydrogen bonds
189 -- 199
D.F. Brougham, A.J. Horsewill, H.P. Trommsdorff
  
Nonphotochemical hole burning in Zn-TBP/PMMA.  Unusual burning 
kinetics and very narrow holewidth limit
201 -- 208
J. Muller, O.V. Khodykin, D. Haarer, B.M. Kharlamov
  
An ab initio molecular orbital study of the electronic spectrum 
and dissociation features of Li2F
209 -- 213
Z. Cao, H. Xian, W. Wu, Q. Zhang
  
On the control of the populations of atomic states through the use of 
a static electric field, pulsed lasers, and competing two-photon
excitation mechanisms
215 -- 228
A.E. Kondo, A. Salam, W.J. Meath
 
Linear response theory and IR spectral density of direct damped weak 
H-bonds: validity of adiabatic approximation
229 -- 248
P. Blaise, O. Henri-Rousseau