Chemical Physics Letters, 2003, V 367, N 3-4, 6 January.
Editorial Board
pp. CO2
Pradyot K. Chowdhury
Dissociation of excited 3-butenoic acid at 193 nm: observation of two channel
OH formation dynamics by laser-induced fluorescence
pp. 253-258
C.M. Roland, R. Casalini and M. Paluch
Isochronal temperature-pressure superpositioning of the -relaxation in type-A
glass formers
pp. 259-264
Sergio S. Gomez, Rodolfo H. Romero and Gustavo A. Aucar
Relativistic mass-corrections to the heavy atom nuclear magnetic shieldings.
Analysis of contributions in terms of localized orbitals
pp. 265-269
G.C. Psarras, J. Parthenios, D. Bollas and C. Galiotis
Stress and temperature self-sensing fibres
pp. 270-277
D. Rayane et al.
Structural electric dipole in small ionic nanocrystals
pp. 278-283
E. Henon, T. Cours and Vl.G. Tyuterev
A CASPT2 study of the dipole moment surfaces of hydrogen sulphide molecule
pp. 284-292
Andrew M. Moran, Anne Myers Kelley and Sergei Tretiak
Excited state molecular dynamics simulations of nonlinear push-pull chromophores
pp. 293-307
Ivan Infante and Francesco Lelj
Role of methyl substitution on the spectroscopic properties of porphyrazines. A
TDDFT study using pure and hybrid functionals on porphyrazine and its octamethyl
derivative
pp. 308-318
Matthias Batzill, Eleonore L.D. Hebenstreit, Wilhelm Hebenstreit and Ulrike
Diebold
Influence of subsurface, charged impurities on the adsorption of chlorine at
TiO2(110)
pp. 319-323
Seyed E. Jalili, Lawrence J. Dunne, George Manos and Ayache Khettar
Statistical mechanics of a two-dimensional lattice model of benzene adsorption
in zeolites
pp. 324-329
Subhasis Panja and Sankar Chakravorti
Photophysics of 4-N,N-dimethylamino cinnamaldehyde in AOT reverse micelles and
exploration of its position and orientation
pp. 330-338
J.Q. Hu, Y. Jiang, X.M. Meng, C.S. Lee and S.T. Lee
A simple large-scale synthesis of very long aligned silica nanowires
pp. 339-343
A. Michaelides, M.-L. Bocquet, P. Sautet, A. Alavi and D.A. King
Structures and thermodynamic phase transitions for oxygen and silver oxide
phases on Ag{111}
pp. 344-350
D. Sivanesan, I. Sumathi and William J. Welsh
Comparative studies between hydrated hydrogen bonded and stacked DNA base pair
pp. 351-360
Jose A. Sanchez-Gil and Jose V. Garcia-Ramos
Local and average electromagnetic enhancement in surface-enhanced Raman
scattering from self-affine fractal metal substrates with nanoscale
irregularities
pp. 361-366
Pawel Dziekonski, W. Andrzej Sokalski, Yevgeniy Podolyan and Jerzy Leszczynski
Nonempirical analysis of the catalytic activity of the molecular environment -
optimal static and dynamic catalytic fields for double proton transfer in
formamide-formamidine complex
pp. 367-375
Taka-aki Ishibashi, Masato Ara, Hirokazu Tada and Hiroshi Onishi
Molecular conformation of n-alkyl monolayers covalently bonded to Si(111) probed
by infrared-visible sum-frequency spectroscopy
pp. 376-381
Bilha Segev and A.V. Sergeev
Dominant channels of vibronic transitions in molecules with several identical
modes
pp. 382-389
Wim Wenseleers et al.
High first hyperpolarizability and perfectly aligned crystal packing for an
organometallic compound [Fe(5-C5H5)((R)-PROPHOS)(p-NCC6H4NO2)][PF6]·CH2Cl2
pp. 390-397
Stefan M. Kast, K. Friedemann Schmidt and Bernd Schilling
Integral equation theory for correcting truncation errors in molecular
simulations
pp. 398-404
F. Pirani, M. Porrini, S. Cavalli, M. Bartolomei and D. Cappelletti
Potential energy surfaces for the benzene-rare gas systems
pp. 405-413
Roman F. Nalewajski
Kinetic energy as functional of the correlation hole
pp. 414-422
Andrew B. Ryzhkov and Parisa A. Ariya
A theoretical study of the reactions of carbonyl oxide with water in atmosphere:
the role of water dimer
pp. 423-429
F. Marinelli and A. Lichanot
Elastic constants and electronic structure of alkaline-earth chalcogenides.
Performances of various hamiltonians
pp. 430-438
Tao Li and Perla B. Balbuena
Oxygen reduction on a platinum cluster
pp. 439-447
Jinlan Wang, Mingli Yang, Guanghou Wang and Jijun Zhao
Dipole polarizabilities of germanium clusters
pp. 448-454
I. Andrianov and P. Saalfrank
Performance of higher order Monte Carlo wave packet methods for surface science
problems: A test for photoinduced desorption
pp. 455-462
Kevin Roussel, Alain Cartier and Alain Marsura
Ab initio DFT investigations on structure of copper(I) bis-diazine complexes
pp. 463-467
Remco W.A. Havenith, Leonardus W. Jenneskens and Patrick W. Fowler
Ring currents that survive bond alternation in constrained 8 and 6 monocycles
pp. 468-474
K. Hernadi, L. Thien-Nga, E. Ljubovi and L. Forro
SWNTs as catalyst and/or support in the catalytic decomposition of hydrocarbons
pp. 475-481
Peng Zhang and Keiji Morokuma
Ab initio molecular orbital study of the weak 2A?2A? transition of the vinyl
radical
pp. 482-488
Stella M. Resende and Fernando R. Ornellas
Thermochemistry of atmospheric sulfur compounds
pp. 489-494
Y.Q. Wang, L.M. Cao and X.F. Duan
Amorphous feather-like boron nanowires
pp. 495-499
F.J. Aoiz et al.
Low temperature rotational relaxation of N2 in collisions with He
pp. 500-506
H. Jeong, K. Oh, S.R. Han and T.F. Morse
Characterization of broadband amplified spontaneous emission from an Er3+-Tm3+
co-doped silica fiber
pp. 507-511
Guo-dan Wei, Yuan Deng and Ce-Wen Nan
Self-organized formation of chainlike silver nanostructure with fractal geometry
pp. 512-515