CHEMICAL PHYSICS LETTERS, 1999, V 302, N 5-6, 26 March.


Yasuki Arasaki, Kazuo Takatsuka, Kwanghsi Wang, Vincent McKoy, Femtosecond
energy- and angle-resolved photoelectron spectra, 
pp. 363-374

So Hirata, Martin Head-Gordon, Time-dependent density functional theory for
radicals,  
pp. 375-382

Takahito Nakajima, Kimihiko Hirao, A new relativistic theory: a
relativistic scheme by eliminating small components (RESC), 
pp. 383-391

Dennis Bonatsos, N. Karoussos, P.P. Raychev, R.P. Roussev, P.A. Terziev,
The 3-dimensional q-deformed harmonic oscillator and magic numbers of
alkali metal clusters,  
pp. 392-398

Noam Agmon, Irina V. Gopich, Kinetic transition in excited-state reversible
reactions,  
pp. 399-404

Christopher J. Bardeen, Jianshu Cao, Frank L.H. Brown, Kent R. Wilson,
Using time-dependent rate equations to describe chirped pulse excitation in
condensed phases,  
pp. 405-410

A.G. Kalinichev, S.V. Churakov, Size and topology of molecular clusters in
supercritical water: a molecular dynamics simulation, 
pp. 411-417

Hidemi Nagao, Syusuke Yamanaka, Masamichi Nishino, Yasunori Yoshioka,
Kizashi Yamaguchi, Theoretical studies on the magnetic quantum tunneling
rates in Mn clusters by the path integral method, 
pp. 418-424

C. David Sherrill, Michael S. Lee, Martin Head-Gordon, On the performance
of density functional theory for symmetry-breaking problems, 
pp. 425-430

Itai Panas, Anders Snis, Filip Acke, Tobias Johnson, Transition metal
complexes with (NO)3- anions,  
pp. 431-436

Asger Halkier, Trygve Helgaker, Poul Jřrgensen, Wim Klopper, Jeppe Olsen,
Basis-set convergence of the energy in molecular Hartree--Fock
calculations,  
pp. 437-446

German Sastre, Avelino Corma, Relation between structure and Lewis acidity
of Ti-Beta and TS-1 zeolites,  
pp. 447-453

F.E. Jorge, E.V.R. de Castro, Improved generator coordinate Hartree--Fock
method: application to first-row atoms, 
pp. 454-460

Carlos Alemán, Solvation of cytosine and thymine using a combined
Discrete/SCRF model,  
pp. 461-470

Gerrit Schüürmann, Gas-phase and solution-phase proton transfer to H2O
analyzed by high-level ab initio quantum chemistry including complete basis
set and Gaussian theory schemes, 
pp. 471-479

Dage Sundholm, Density functional theory calculations of the visible
spectrum of chlorophyll a,  
pp. 480-484

N. Balakrishnan, A. Dalgarno, Rate coefficients for NO formation in
energetic N+O2 collisions,  
pp. 485-488

O. Rubner, V. Engel, M.R. Hachey, C. Daniel, A CASSCF/MR-CCI study of the
excited states of Fe(CO)5,  
pp. 489-494

Satoshi Yokojima, DongHao Zhou, GuanHua Chen, Linear-scaling computation of
ground state with time-domain localized-density-matrix method, 
pp. 495-498

Anita M. Orendt, Julio C. Facelli, David M. Grant, A theoretical study of
the acetate 13C chemical shift tensor in cadmium acetate dihydrate,
pp. 499-504

Lauro Camargo Dias, Jr., Rogério Custodio, Francisco B.T. Pessine,
Theoretical studies of Nile Red by ab initio and semiempirical methods,
pp. 505-510

Seong Han Kim, Peter C. Stair, Eric Weitz, Substrate-mediated
photodesorption from multilayers of CH3I on TiO2(110) at 90 K, 
pp. 511-516

V.T. Joy, Lisa George, T.K.K. Srinivasan, Adsorption of
1,3-dithiol-2-thione-4,5-dithiolate on silver surface studied by
surface-enhanced Raman spectroscopy, 
pp. 517-522

C. Lafuente, C. Mingotaud, P. Delhaes, A Langmuir--Blodgett film presenting
a ferromagnetic state below 25 K, 
pp. 523-527

E.V. Alieva, L.A. Kuzik, V.A. Yakovlev, G. Knippels, A.F.G. van der Meer,
G. Mattei, Spectroscopy of a thin fullerene film on silver using sum
frequency generation enhanced by visible surface plasmon--polaritons,
pp. 528-532

R.A. Jishi, M.S. Dresselhaus, Vibrational frequencies in C36, 
pp. 533-537

Matthew R. Hockridge, Evan G. Robertson, John P. Simons, Ion-dip
spectroscopy and structure of 5-phenyl imidazole, 4-phenyl imidazole and
its 1:1 hydrate,  
pp. 538-548

A. Thiel, A. Bousseksou, M. Verelst, F. Varret, J.P. Tuchagues, Dynamic
spin--crossover in [FeII(TRIM)2]Br2 and [FeII(TRIM)2](HCO2)2 investigated
by Mössbauer spectroscopy and magnetic measurements, 
pp. 549-554

K.W. Aniolek, P.E. Powers, T.J. Kulp, B.A. Richman, S.E. Bisson, Cavity
ringdown laser absorption spectroscopy with a 1 kHz mid-infrared
periodically poled lithium niobate optical parametric generator/optical
parametric amplifier,  
pp. 555-562

F. Stellacci, C. Bertarelli, F. Toscano, M.C. Gallazzi, G. Zerbi,
Diarylethene-based photochromic rewritable optical memories: on the
possibility of reading in the mid-infrared, 
pp. 563-570

P. Lievens, P. Thoen, S. Bouckaert, W. Bouwen, F. Vanhoutte, H. Weidele,
R.E. Silverans, Evidence for size-dependent electron delocalization in the
ionization potentials of lithium monocarbide clusters, 
pp. 571-576

Mototada Nakai, Kiminori Maeda, Hisao Murai, Delayed fluorescence detected
magnetic resonance study on the spin dynamics of the transient radical-ion
pair formed in the photolysis of carbazole in 2-propanol, 
pp. 577-582

Horst Kunkely, Arnd Vogler, Photoluminescence of
dicyclopentadienylniobium(IV) complexes, 
pp. 583-586

M. Helbig, A. Ruseckas, M.M.-L. Grage, E. Birckner, S. Rentsch, V.
Sundström, Resolving the radical cation formation from the lowest-excited
singlet (S1) state of terthiophene in a TiO2--SiO2 hybrid polymer matrix,
pp. 587-594

Michalis Velegrakis, George E. Froudakis, Stavros C. Farantos, Coordination
of Ti cation embedded in argon clusters, 
pp. 595-601

Laurie M. Yoder, John R. Barker, K. Thomas Lorenz, David W. Chandler, Ion
imaging the recoil energy distribution following vibrational
predissociation of triplet state pyrazine--Ar van der Waals clusters,
pp. 602-608

Kaoru Yamamoto, Toshihide Kamata, Shinichiro Iwai, Said Kazaoui, Nobutsugu
Minami, Fujio Mizukami, Kazuhiko Misawa, Toshiaki Ohta, Takayoshi
Kobayashi, Franz--Keldysh oscillation in the interband absorption spectrum
of one-dimensional bis(dimethylglyoximato)platinum(II) complex, 
pp. 609-614

Kenji Kamada, Takushi Sugino, Minoru Ueda, Keiko Tawa, Yo Shimizu, Koji
Ohta, Femtosecond optical Kerr study of heavy-atom effects on the
third-order optical non-linearity of thiophene homologues: electronic
hyperpolarizability of tellurophene, 
pp. 615-620

Robert Schiller, András Hámori, Pattern formation in a class of homogeneous
photochemical reactions,  
pp. 621-626

Camille Loupiac, Nicolay Kruk, Pierre Valat, Bernard Alpert, Protein
relaxation without a geminate phase in nanosecond photodissociated CO carp
hemoglobin,  
pp. 627-632

Claus Czeslik, Jiri Jonas, Pressure and temperature dependence of
hydrogen-bond strength in methanol clusters, 
pp. 633-638