Chemical Physics Letters, 1998, V 287, N 5-6, 8 May.


C. Meier, V. Engel, J.A. Beswick, Single-collision caging of dissociating
I2: wave packet calculations and simulation of femtosecond spectra,
pp. 487-495

R. Sumathi, M. Hendrickx, Quantum chemical calculations on the structure
and electronic properties of TiC2, 
pp. 496-502

Dongfeng Xue, Siyuan Zhang, Calculations of nonlinear optical responses of
isomorphous crystals NaClO3 and NaBrO3 with natural optical activity,
pp. 503-508

Ingrid Miadoková, Vladimir Kellö, Geerd H.F. Diercksen, Static dipole
polarizabilities and hyperpolarizabilities of dicyanopolyacetylenes,
pp. 509-514

D. Inard, A.J. Bouvier, R. Bacis, S. Churassy, F. Bohr, J. Brion, J.
Malicet, M. Jacon, Absorption cross-sections and lifetime of the 3A2
`metastable' state of ozone,  
pp.515-524

Ulf Wahlgren, Bernd Schimmelpfennig, Sutjano Jusuf, Hege Strömsnes, Odd
Gropen, Laurent Maron, A local approximation for relativistic scalar
operators applied to the uranyl ion and to Au2,  
pp. 525-530

Imre Pápai, András Stirling, János Mink, Kazuo Nakamoto, Can the FeCO
bending be higher than the FeC stretching frequency in CO adducts of heme
proteins?,  
pp. 531-534

C.E Swenberg, M. Pope, An observation on the mobility and the carrier
effective mass in naphthalene,  
pp. 535-536

Michael E. Colvin, Curtis L. Janssen, Edward T. Seidl, Ida M.B. Nielsen,
Carl F. Melius, Energies, resonance and UHF instabilities in polycyclic
aromatic hydrocarbons and linear polyenes,  
pp. 537-541

Reinaldo Pis Diez, A density functional test on the interaction of H2 with
Pt,  
pp. 542-548

Robert Cazar, Alan Jamka, Fu-Ming Tao, Proton transfer reaction of hydrogen
chloride with ammonia: is it possible in the gas phase?, 
pp. 549-552

Takeshi Tsurusawa, Suehiro Iwata, Dipole-bound and interior electrons in
water dimer and trimer anions: ab initio MO studies, 
pp. 553-562

Edgar W. Ignacio, Shinichi Yamabe, A symmetric structure of the gas-phase
H3+(H2)9 cluster,  
pp. 563-569

Y.Z. Chen, V. Mohan, R.H. Griffey, Effect of backbone ζ torsion angle
on low energy single base opening in B-DNA crystal structures, 
pp. 570-574

Hafid Anane, Abderrahim Boutalib, Ignacio Nebot-Gil, , G2(MP2)2mrr01 study
of the substituent effects in the H3BXHnMe3-n (X=N, P; n=0--3)
donor--acceptor complexes,  
pp. 575-578

Hamilton Mitsugu Ishiki, Carlos Alemán, Sérgio Emanuel Galembeck,
Conformational preferences of flavone and isoflavone in the gas phase,
aqueous solution and organic solution, 
pp. 579-584

Frederico V. Prudente, J.J. Soares Neto, The fitting of potential energy
surfaces using neural networks. Application to the study of the
photodissociation processes,  
pp. 585-589

Anders R. Sřrnes, Nikolas P. Benetis, Theory of electron spin-echo envelope
modulation in isotropic tunneling methyl rotor systems, 
pp. 590-596

Martina Kieninger, Marc Segovia, Oscar N. Ventura, A discrepancy between
experimental and theoretical thermochemical characterization of some oxygen
fluorides,  
pp. 597-600

Stefan Grimme, Markus Woeller, Sigrid D. Peyerimhoff, David Danovich, Sason
Shaik, Theoretical study of the radiationless decay channels of triplet
state norbornene,  
pp. 601-607

Saba M. Mattar, Minimum general requirements for equivalent atoms in a
molecule, 
pp. 608-612

Miyabi Hiyama, Kiyohiko Someda, Ionization of atoms in intense laser
fields. Strong mixing of auto- and photoionizations, 
pp. 613-619

J.R. Sambrano, J. Andrés, A. Beltrán, F. Sensato, E. Longo, Theoretical
study of the structure and stability of NbxOy and NbxOy+ (x=1--3; y=2--5,
7, 8) clusters, 
pp. 620-626

Y. Ohtsuki, Y. Yahata, H. Kono, Y. Fujimura, Application of a locally
optimized control theory to pump--dump laser-driven chemical reactions,
pp. 627-631

Seiichiro Nakabayashi, Ryo Baba, Yuka Shiomi, Spatiotemporal propagation of
a non-linear electrochemical reaction over an iron electrode, 
pp. 632-638

J. Kinugasa, S. Shimada, H. Matsuda, H. Nakanishi, T. Kobayashi, Relaxation
dynamics of excitons in polydiacetylene crystals,  
pp. 639-644

C.T. Aravindakumar, T.A. Jacob, H. Mohan, H.S. Mahal, T. Mukherjee, J.P.
Mittal, Anomalous high reactivity of formyl and acetone ketyl radicals with
uracil and its derivatives,  
pp. 645-652

Akihiro Matsuo, Kenji Furuya, Teiichiro Ogawa, A new band of O+ observed in
measurements of angle-resolved translational energy by electron impact on O2,  
pp. 653-658

Xiao Zhang, Xingren Liu, Jean Pierre Jouart, Gérard Mary, Upconversion
fluorescence of Ho3+ ions in a BaF2 crystal, 
pp. 659-662

M.F. Bertino, S. Miret-Artés, J.P. Toennies, Observation of elastic
rotationally mediated critical kinematic selective adsorption in D2
scattering from Cu(001),  
pp. 663-670

Rahul Sen, B.C. Satishkumar, A. Govindaraj, K.R. Harikumar, Gargi Raina,
Jin-Ping Zhang, A.K. Cheetham, C.N.R. Rao, B--C--N, C--N and B--N nanotubes
produced by the pyrolysis of precursor molecules over Co catalysts,
pp. 671-676

Sonia Coriani, Michal Jaszunski, Antonio Rizzo, Kenneth Ruud, MCSCF nuclear
magnetic shieldings and spin-rotation constants of 17O in 16O 17O 16O and
17O 16O 16O,  
pp. 677-681

M. Brouard, I. Burak, S.D. Gatenby, G.A.J. Markillie, The product
state-resolved dynamics of the reaction H + N2O -> OH(v',j') + N2,
pp. 682-688

Y.Q. Zhu, T. Sekine, T. Kobayashi, E. Takazawa, M. Terrones, H. Terrones,
Collapsing carbon nanotubes and diamond formation under shock waves,
pp. 689-693

Shoichi Yamaguchi, Hiro-o Hamaguchi, Femtosecond visible absorption study
of excited-state dynamics of 9-cis retinal, 
pp. 694-700

Yun-Jung Jee, Moon Soo Park, Yong Shin Kim, Young-Jae Jung, Kyung-Hoon
Jung, Photodissociation of bromine molecule near 265 nm,
pp. 701-708

Marcus Hilgendorff, Villy Sundström, Ultrafast electron injection and
recombination dynamics of dye sensitised TiO2 particles, 
pp. 709-713

Iwao Watanabe, Naoko Takahashi, Hajime Tanida, Dehydration of iodide
segregated by tetraalkylammonium at the air/solution interface studied by
photoelectron emission spectroscopy,
pp. 714-718

S.F. Chekmarev, S.V. Krivov, Confinement of the molecular dynamics
trajectory to a specified catchment area on the potential surface, 
pp. 719-724

Tsuneo Fujii, Yukio Isowaki, Takeshi Nomoto, Nobuaki Tanaka, Shozi Mishima,
Enhancement of charge-transfer complex formation between
1,4-dimethyl-naphthalene and p-chloranil during the sol--gel reaction of
tetraethyl orthosilicate,  
pp. 725-730

S. Xu, Han-shi Li, Yin-an Li, S. Lee, C.H.A. Huan, On the structure and
composition of polycrystalline carbon nitride films synthesized by reactive
rf magnetron sputtering, 
pp. 731-736

Youichi Kurokawa, Takayuki Ishizaka, Tadaaki Ikoma, Shozo Tero-Kubota,
Photo-properties of rare earth ion (Er3+, Eu3+ and Sm3+)-doped alumina
films prepared by the sol--gel method,
pp. 737-741

J.M. Coquel, L. Siller, J. Wilkes, R. Carrapa, C.L.A. Lamont, T. Almeida
Gasche, R.E. Palmer, A.M.C. Moutinho, Photodissociation of condensed carbon
dioxide below the gas phase thresholds, 
pp. 742-746

Wei-Qiao Deng, Ke-Li Han, Ji-Ping Zhan, Guo-Zhong He, W.M. Jackson,
Collisional energy transfer in highly vibrationally excited C70 , 
pp. 747-752

S. Meyer, M. Schmitt, A. Materny, W. Kiefer, V. Engel, Errratum to ``A
theoretical analysis of the time-resolved femtosecond CARS spectrum of
I2'',  
pp. 753-754