Chemical Physics Letters, 2003, V 381, N 1-2, 4 November.


1.   
 A strategy for the synthesis of nanocrystal films of metal 
 chalcogenides and oxides by employing the 
 liquid–liquid interface,  
 Ujjal K. Gautam, Moumita Ghosh and C. N. R. Rao
 Pages 1-6

2.   
 The electronic structure of metal/alkane thiol self-assembled 
 monolayers/metal junctions for magnetoelectronics applications, 
 Y. A. Ovchenkov, H. Geisler, J. M. Burst, S. N. Thornburg, 
 C. A. Ventrice, Jr. , Chunjuan Zhang, J. Redepenning, 
 Y. Losovyj, Luis Rosa et al.
 Pages 7-13 

3.   
 Atmospheric chemistry of C2F5CHO: mechanism of the 
 C2F5C(O)O2 + HO2 reaction, 
 M. P. Sulbaek Andersen, M. D. Hurley, T. J. Wallington, 
 J. C. Ball, J. W. Martin, D. A. Ellis and S. A. Mabury
 Pages 14-21 

4.   
 On the structures of the methanol trimer and their 
 cooperative effects, 
 Marcos Mandado, Ana M. Grana and Ricardo A. Mosquera
 Pages 22-29 

5.   
 The permanent electric dipole moments of the X 3,E 3,A 3 
 and B 3 states of titanium monoxide, TiO,  
 Timothy C. Steimle and Wilton Virgo
 Pages 30-36

6.   
 Direct dynamics study of the photodissociation of triplet
 propanal at threshold, 
 M. N. D. S. Cordeiro, E. Martinez-Nunez, A. Fernandez-Ramos 
 and S. A. Vazquez
 Pages 37-44 

7.   
 Calculated structures of [Au=C=Au]2+ and related systems, 
 Pekka Pyykko, Michael Patzschke and Jaak Suurpere
 Pages 45-52 

8.   
 Molecular dissociation observed with an atomic wavepacket 
 and parametric four-wave mixing,
 A. A. Senin, H. C. Tran, J. Gao, Z. H. Lu, C. J. Zhu, 
 A. L. Oldenburg, J. R. Allen and J. G. Eden
 Pages 53-59 

9.   
 Crossover from diffusion to annihilation limited 
 phosphorescence in conjugated polymers,
 M. Reufer, F. Schindler, S. Patil, U. Scherf and J. M. Lupton
 Pages 60-66

10.   
 Effect of electron correlation on momentum properties 
 of helium atom,  
 B. Talukdar, A. Sarkar, S. N. Roy and P. Sarkar
 Pages 67-73
 -
11.   
 Fabrication and characterization of hollow spherical 
 boron nitride powders, 
 Liqiang Xu, Yiya Peng, Zhaoyu Meng, Debao Wang, 
 Wanqun Zhang and Yitai Qian
 Pages 74-79 

12.   
 Accurate electron-pair, momentum-space properties 
 for the helium atom, 
 Ajit J. Thakkar
 Pages 80-85 

13.   
 Organization of single-walled nanotubes into 
 macro-sized rectangularly shaped ribbons, 
 M. L. Terranova, S. Orlanducci, E. Fazi, V. Sessa, 
 S. Piccirillo, M. Rossi, D. Manno and A. Serra
 Pages 86-93  

14.   
 Structural calculation and properties of one-dimensional 
 Pt materials, 
 Li Hui, F. Pederiva, Wang Guanghou and Wang Baolin
 Pages 94-101 

15.   
 A symmetric hydrogen bond revisited: potassium hydrogen 
 maleate by variable temperature, variable pressure neutron 
 diffraction and plane-wave DFT methods, 
 Chick C. Wilson, Lynne H. Thomas and Carole A. Morrison
 Pages 102-108 

16.   
 Ab initio study of hydride abstraction reaction in the 
 Mg+–NH2CH3 complex, 
 Wenyue Guo, Xiaoqing Lu, Songqing Hu and Shihe Yang
 Pages 109-116 

17.   
 Gaussian resolutions for equilibrium density matrices, 
 Pavel Frantsuzov, Arnold Neumaier and Vladimir A. Mandelshtam
 Pages 117-122 

18.   
 The SF6- enigma for density functional theory: is the KMLYP 
 functional a reasonable solution for this problematic anion?, 
 Nicole R. Brinkmann and Henry F. Schaefer III
 Pages 123-128 

19.   
 Simulating dissipative phenomena with a random phase thermal 
 wavefunctions, high temperature application of the Surrogate 
 Hamiltonian approach, 
 David Gelman and Ronnie Kosloff
 Pages 129-138 

20.   
 Using ultrafast infrared multidimensional correlation spectroscopy 
 to aid in vibrational spectral peak assignments, 
 John B. Asbury, Tobias Steinel and M. D. Fayer
 Pages 139-146 

21.   
 Huckel-like rule of superaromaticity for charged 
 paracyclophanes,  
 Jun-ichi Aihara
 Pages 147-153

22.   
 Electron exchange on TiO2–SiO2 photocatalysts during O2 
 and organic molecule adsorption – the role of 
 adsorbate electrophilicity, 
 D. Panayotov and J. T. Yates, Jr.
 Pages 154-162 

23.   
 A new monomeric interpretation of intrinsic optical 
 bistability observed in Yb3+-doped bromide materials,
 F. Ciccarello, A. Napoli, A. Messina and S. R. Luthi
  Pages 163-167

24.   
 Sulfur hexafluoride corona discharge decomposition: gas-phase 
 ion chemistry of SOFx+ (x=1–3) ions, 
 Federico Pepi, Andreina Ricci, Marco Di Stefano and Marzio Rosi
  Pages 168-176

25.   
 A new method for constructing multidimensional potential 
 energy surfaces by a polar coordinate interpolation technique, 
 Satoshi Maeda and Koichi Ohno
 Pages 177-186 


26.   
 Electronic properties of formaldehyde in water: a theoretical study, 
 A. Amadei, M. D'Abramo, C. Zazza and M. Aschi
 Pages 187-193 

27.   
 Reduction–boronation route to chromium boride (CrB) nanorods, 
 Jianhua Ma, Yunle Gu, Liang Shi, Luyang Chen, Zeheng Yang and Yitai Qian
 Pages 194-198 

28.   
 Kinetic studies on reactions of NCO(X 2i) with alcohol molecules, 
 Linsen Pei, Changjin Hu, Yunzhen Liu, Zhiqiang Zhang, Yang Chen and Congxiang Chen
 Pages 199-204 

29.   
 Some theoretical predictions on the coplanar di-dodecahedral molecule C5N30, 
 Feng-Ling Liu
 Pages 205-209

30.   
 Water confined in nanopores: its molecular distribution and diffusion 
 at lower density,  
 Ying-Chun Liu, Qi Wang and Ling-Hong Lu
 Pages 210-215

31.   
 Low energy electron attachment to CH3CN, 
 W. Sailer, A. Pelc, P. Limao-Vieira, N. J. Mason, 
 J. Limtrakul, P. Scheier, M. Probst and T. D. Mark
 Pages 216-222

32.   
 A size-extensive state-specific multi-reference many-body 
 approach using incomplete model spaces, 
 Dola Pahari, Sudip Chattopadhyay, Sanghamitra Das and Debashis Mukherjee
 Pages 223-229 

33.   
 Effect of structural changes in sesquifulvalene on the intramolecular 
 charge transfer and nonlinear polarizations – 
 a theoretical study, 
 P. K. Nandi, K. Mandal and T. Kar
 Pages 230-238 

34.   
 Theoretical study on cation oscillation through the 
 calix[4]arene-bis-crown-5 cavity,  
 Kiyull Yang, Keum Duck Kang, Young Hee Park, 
 In Sun Koo and Ikchoon Lee
 Pages 239-243

35.   
 Comment on `Thermodynamic cycles and the calculation of pKa' 
 [Chem. Phys. Lett. 367 (2003) 145], 
 Clarissa O. da Silva, Edilson C. da Silva and Marco A. C. Nascimento
 Pages 244-245 

36.   
 Reply to comment on: `Thermodynamic cycles and the calculation of 
 pKa' [Chem. Phys. Lett. 367 (2003) 145], 
 Josefredo R. Pliego, Jr.
 Pages 246-247 

37.   
 Comment on `Theoretical study on PbS, PbO and their anions' 
 [Chem. Phys. Lett. 370 (2003) 39], 
 Young-Kyu Han
 Pages 248-250 

38.   
 Reply to `Comment on: Theoretical study on PbS, PbO and their anions 
 [Chem. Phys. Lett. 370 (2003) 39]', 
 Z. J. Wu
 Pages 251-252 

39.   
 Erratum to `Generalized ensembles serve to improve the convergence 
 of free energy simulations' [Chem. Phys. Lett. 377 (2003) 
 693–641], 
 R. Bitetti-Putzer and M. Karplus
 Page 253 

40.   
 Editorial board, 
 Page CO2