Chemical Physics Letters, 2004, V 390, N 4-6, 1 June.


  
1.   
 Partially and fully deprotonated sulfuric acid
 in H2SO4(H2O)n (n=6;9) clusters  ; 
 Chang-Geng Ding and Kari Laasonen
 Pages 307-313 
 
2.   
 The role of the 11Bu; state in carotenoid-to-bacteriochlorophyll
 singlet-energy transfer in the LH2 antenna complexes
 from Rhodobacter sphaeroides G1C, Rhodobacter
 sphaeroides 2.4.1, Rhodospirillum molischianum
 and Rhodopseudomonas acidophila  ; 
 Ferdy S. Rondonuwu, Kyosuke Yokoyama, Ritsuko Fujii,
 Yasushi Koyama, Richard J. Cogdell and Yasutaka Watanabe
 Pages 314-322
 
3.   
 Energy distributions of CO produced in an
 acetone-containing discharge  ; 
 Peng Li and Wai Yip Fan
 Pages 323-327 
 
4.   
 Switching dynamics of the photochromic 
 1,1-dicyano-2-(4-cyanophenyl)-1,8a-dihydroazulene 
 probed by sub-30 fs spectroscopy  ; 
 Vincent De Waele, Matthias Beutter, 
 Uli Schmidhammer, Eberhard Riedle
 and Jorg Daub
 Pages 328-334 
 
5.   
 A periodic first principle study to design microporous
 crystal 12MO, 7Al2O3 for selective and
 active O; radicals encaging  ; 
 Abhijit Chatterjee, Masateru Nishioka and 
 Fujio Mizukami
 Pages 335-339 
 
6.   
 Near infrared absorptions of CH4/He plasma: 
 the Phillips band system of C2*1  ; 
 Man-Chor Chan, Shun-Hin Yeung, Yuen-Yee Wong,
 Yongfang Li, Wang-Ming Chan and Kan-Hing Yim
 Pages 340-346 
 
7.   
 Evidence for two light-induced metastable
 states in Cl3[Ru(NH3)5NO]H2O  ; 
 D. Schaniel, T. Woike, C. Boskovic and H. -U. Gudel
 Pages 347-351 
 
8.   
 A new alligator-clip compound for molecular electronics  ; 
 Timo Jacob, Mario Blanco and William A. Goddard, III
 Pages 352-357 
 
9.   
 Towards the understanding of the spectroscopic
 behaviour of the C;H oscillator in C;H···O hydrogen
 bonds: the effect of solvent polarity  ; 
 Paulo J. A. Ribeiro-Claro and Pedro D. Vaz
 Pages 358-361 
 
10.   
 Theoretical calculational studies on the mechanism
 of thermal dissociations for RN3 (R=CH3, 
 CH3CH2, (CH3)2CH, (CH3)3C)  ; 
  Yanli Zeng, Qiao Sun, Lingpeng Meng, Shijun Zheng
 and Dianxun Wang
 Pages 362-369 
 
11.   
 State-to-state dissociation rate coefficients in 
 electronically excited diatomic gases  ; 
 A. Aliat, Elena V. Kustova and A. Chikhaoui
 Pages 370-375 
 
12.   
 Determination of the first ionization energy of furan
 (C4H4O) from an extrapolation of two nd Rydberg
 series observed in the mass-resolved (2 + 1)
 resonance enhanced multiphoton ionization spectrum  ; 
 Trevor Ridley, Kenneth P. Lawley, Mohamed H. S. N. 
 Al-Kahali and Robert J. Donovan
 Pages 376-379 
 
13.   
 Force acting on the microparticles in 
 electrorheological solids under the 
 application of a nonuniform ac electric field  ; 
 J. P. Huang
 Pages 380-383
 
14.   
 Solvent-mediated tautomerization of purine: 
 single to quadruple proton transfer  ; 
 Doo-Sik Ahn, Sungyul Lee and Bongsoo Kim
 Pages 384-388 
 
15.   
 In situ characterization of surface physicochemical
 properties of carbon nanofibers using
 -naphthol as a fluorescent probe  ; 
Hiromasa Nishikiori, Nobuaki Tanaka, Satoshi Kubota,
Morinobu Endo and Tsuneo Fujii
 Pages 389-393
 
16.   
 An efficient algorithm for calculating whole-profile
 functions in crystal structure solution from
 powder diffraction data  ; 
 Scott Habershon, Eugene Y. Cheung,
 Kenneth D. M. Harris and Roy L. Johnston
 Pages 394-398 
 
17.   
 Charge separation at the rutile/anatase interface: 
 a dominant factor of photocatalytic activity  ; 
 Takahira Miyagi, Masayuki Kamei, 
 Takefumi Mitsuhashi, Takamasa Ishigaki 
 and Atsushi Yamazaki
 Pages 399-402
 
18.   
 Yb3+ ion as a sensitizer for the upconversion
luminescence in nanocrystalline Gd3Ga5O12:Ho3+  ; 
J. C. Boyer, F. Vetrone, J. A. Capobianco, 
A. Speghini and M. Bettinelli
Pages 403-407 
 
19.   
 Nuclear magnetic resonance shielding tensors
 calculated with kinetic energy density-dependent
 exchange-correlation functionals  ; 
 Sergey N. Maximoff and Gustavo E. Scuseria
 Pages 408-412 
 
20.   
 The role of vacancy defects and holes in
 the fracture of carbon nanotubes  ; 
 Steven L. Mielke, Diego Troya, Sulin Zhang,
 Je-Luen Li, Shaoping Xiao, Roberto Car, 
 Rodney S. Ruoff, George C. Schatz and 
 Ted Belytschko
 Pages 413-420  
 
21.   
 A density functional theory study applied for 
 carbon and oxygen isotope effects in the system Ni(CO)4/CO  ; 
 Yuriko Ono, Yasuhiko Fujii and Takanobu Ishida
 Pages 421-426 
 
22.   
 Time resolved resonance Raman studies on
 triplet excited state of 2-methoxy-naphthalene
 by photo-sensitization  ; 
 Himansu Mohapatra and Siva Umapathy
 Pages 427-432 
 
23.   
 Two-photon absorption properties of star-shaped
 molecules containing peripheral diarylthienylamines  ; 
 Sean Liu, Kuen Shen Lin, Victor M. Churikov,
 Yi Zhen Su, Jiann Tsuen Lin, Tzer-Hsiang Huang
 and Chia Chen Hsu
 Pages 433-439
 
24.   
 Nano-scale effects in electrochemistry*1  ; 
 J. Meier, J. Schiotz, P. Liu, J. K. Norskov
 and U. Stimming
 Pages 440-444 
 
25.   
 Impedance spectroscopy of the electrode-tissue 
 interface of living heart with isoosmotic 
conductivity perturbation*1  ; 
 Marc Ovadia and Daniel H. Zavitz
 Pages 445-453 
 
26.   
 Comparison between semiclassical and 
 composite absorbing potentials  ; 
 J. G. Muga and B. Navarro
 Pages 454-457 
 
27.   
 Identification of the point defects in diamond as
 measured by Raman spectroscopy: comparison
 between experiment and computation  ; 
 S. Prawer, Irina Rosenblum, J. O. Orwa and Joan Adler
 Pages 458-461 
 
28.   
 Structural evolutions of carbon nano-peapods
 under electron microscopic observation  ; 
 Alexandre Gloter, Kazutomo Suenaga, Hiromichi Kataura,
 Ryosuke Fujii, Takeshi Kodama, Hiroyuki Nishikawa,
 Isao Ikemoto, Koichi Kikuchi, Shinzo Suzuki, 
 Yohji Achiba and Sumio Iijima
 Pages 462-466 
 
29.   
 Intermediate phase upon alloying Au;Ag nanoparticles
 under laser exposure of the mixture of individual colloids  ; 
 A. T. Izgaliev, A. V. Simakin, G. A. Shafeev
 and F. Bozon-Verduraz
 Pages 467-471
 
30.   
 Endohedral complexes of C58 cage with H2 and CO  ; 
 Yun Hang Hu and Eli Ruckenstein
 Pages 472-474 
 
31.   
 Electron-ion recombination in dense gaseous and
 liquid argon: effects due to argon cation clusters
allow to explain the experimental data  ; 
Mariusz Wojcik and M. Tachiya
Pages 475-480 
 
32.   
 Degradation of vitamin C by low-energy electrons  ; 
 Hassan Abdoul-Carime and Eugen Illenberger
 Pages 481-484 

 33.   
 Newly developed ab initio fitted potentials for molecular
 dynamics simulations of n-pentane in the zeolite silicalite-1  ; 
 A. Loisruangsin, S. Fritzsche and S. Hannongbua
 Pages 485-490 

34.   
 The entry pathway of O2 into human ferritin  ; 
 Lucio Colombi Ciacchi and Mike C. Payne
 Pages 491-495 
 
35.   
 CCSDT and CCSD(T) calculations on model H-bonded
 and stacked complexes  ; 
 Jii Pittner and Pavel Hobza
 Pages 496-499 
 
36.   
 Impact of receptor conformation on in silico
 screening performance  ; 
 H. Merlitz, B. Burghardt and W. Wenzel
 Pages 500-505 
 
37.   
 Two-photon absorption investigation in reduced
 and oxidized cytochrome c solutions  ; 
 A. A. Andrade, N. M. Barbosa Neto, L. Misoguti, 
 L. De Boni, S. C. Zilio and C. R. Mendonca
 Pages 506-510 
 
38.   
 A molecular dynamics study on the conformational 
 stability of PrP 180;193 helix II prion fragment  ; 
 M. Pappalardo, D. Milardi, C. La Rosa, C. Zannoni, 
 E. Rizzarelli and D. Grasso
 Pages 511-516 
 
39.   
 Complexes of cationic coinage metal clusters
 Mn+ (M=Cu, Ag, Au; n=1;4) and H2S: a theoretical study  ; 
 I. P. Hamilton
 Pages 517-521 
 
40.   
 Author index  ; 
Pages 522-530 

 
41.   
 Editorial board  ; 
Page CO2