Journal of Physical Chemistry, 2003, Vol. 107, No. 6, 13 February.

EDITORIAL

New Feature in The Journal of Physical Chemistry A/B
Mostafa A. El-Sayed
pp 771 - 771; 

LETTERS


The Benzene/Water/Hexafluorobenzene Complex: A Computational Study
Mario Raimondi, Gabriele Calderoni, Antonino Famulari, Laura Raimondi, and Franco Cozzi
pp 772 - 774; 

ARTICLES

SPECTROSCOPY, GASEOUS CLUSTERS, AND MOLECULAR BEAMS

Gas Phase Study of the Clustering Reactions of C2H5+, s-C3H7+, and t-C4H9+ with 
CO2 and N2O: Isomeric Structure of C2H5+, C2H5+(CO2)n, and C2H5+(N2O)n
Kenzo Hiraoka, Takashi Shoda, Ichiro Kudaka, Susumu Fujimaki, Susumu Mizuse, 
Shinichi Yamabe, Hiroaki Wasada, and Yuko Wasada-Tsutsui
pp 775 - 781;  

Vibrational and Electronic Spectroscopy of Acenaphthylene and Its Cation
John Banisaukas, Jan Szczepanski, John Eyler, Martin Vala, So Hirata, Martin 
Head-Gordon, Jos Oomens, Gerard Meijer, and Gert von Helden
pp 782 - 793;  

Electron Autodetachment from Isolated Nickel and Copper Phthalocyanine-
Tetrasulfonate Tetraanions: Isomer Specific Rates
Katharina Arnold, Teodor Silviu Balaban, Martine N. Blom, Oli T. Ehrler, Stefan 
Gilb, Oliver Hampe, Johan E. van Lier, J. Mathias Weber, and Manfred M. Kappes
pp 794 - 803; 

Photochemical Double-Proton-Transfer Reactions in 2,6-Dithiopurine. A Matrix
 Isolation Study
Hanna Rostkowska, Leszek Lapinski, and Maciej J. Nowak
pp 804 - 809; 

KINETICS; ATMOSPHERIC AND ENVIRONMENTAL PHYSICAL CHEMISTRY

Benzopinacol Radical Cation
Jacek Rogowski, Jacek Zielonka, Andrzej Marcinek, Jerzy Gbicki, and Pawe  Bednarek
pp 810 - 814;  

Investigation of the Stereodynamics of Axially Chiral 1,8-Bis(2,2'-diphenyl-
4,4'-dipyridyl)naphthalene and Cryogenic Separation of Its syn/anti-Isomers
Christian Wolf and Gilbert E. Tumambac
pp 815 - 817;  

Rate Constants for RO2 + HO2 Reactions Measured under a Large Excess of HO2
Andrew A. Boyd, Pierre-Marie Flaud, Nicolas Daugey, and Robert Lesclaux
pp 818 - 821;  

MOLECULAR STRUCTURE, BONDING, QUANTUM CHEMISTRY, AND GENERAL THEORY

Ionization Energies and Dyson Orbitals of Cytosine and 1-Methylcytosine
O. Dolgounitcheva, V. G. Zakrzewski, and J. V. Ortiz
pp 822 - 828;  

Ab Initio Study of Cis-Trans Photoisomerization in Stilbene and Ethylene
Jason Quenneville and Todd J. Marti'nez
pp 829 - 837;  

Structure-Property Relationships in Phosphole-Containing 
 -Conjugated Systems: A Quantum 
Chemical Study
David Delaere, Minh Tho Nguyen, and Luc G. Vanquickenborne
pp 838 - 846; 

Stucture and Conformational Properties of Bis(trifluoromethyl) 
Peroxydicarbonate, CF3OC(O)O-OC(O)OCF3
Drahomi'r Hnyk, Jan Macha'ek, Gustavo A. Argu"ello, Helge Willner,
and Heinz Oberhammer
pp 847 - 851;  

Spin-Orbit and Relativistic Effects on Structures and Stabilities of Group 17 
Fluorides EF3 (E = I, At, and Element 117): Relativity Induced Stability for the 
D3h Structure of (117)F3
Cheolbeom Bae, Young-Kyu Han, and Yoon Sup Lee
pp 852 - 858; 

D3d Ground-State Structure of V(CO)6: A Combined Matrix Isolation and ab Initio 
Study of the Jahn-Teller Effect
Eduard Bernhardt, Helge Willner, Andreas Kornath,, Ju"rgen Breidung, Michael 
Bu"hl, Volker Jonas, and Walter Thiel
pp 859 - 868; 

Gas-Phase Thermodynamic Properties of Dichlorophenols Determined from Density 
Functional Theory Calculations
Jose' R. B. Gomes and Manuel A. V. Ribeiro da Silva
pp 869 - 874; 

Mesoscopic Treatment of a Fluid/Liquid Interface. 1. Theory
Aly J. Castellanos, German Urbina-Villalba, and Ma'ximo Garci'a-Sucre
pp 875 - 882; 

Mesoscopic Treatment of a Fluid/Liquid Interface. 2. Air/Water Interfacial 
Tension
Aly J. Castellanos, German Urbina-Villalba, and Ma'ximo Garci'a-Sucre
pp 883 - 887;  

Theoretical Calculation of ClONO2 and BrONO2 Bond Dissociation Energies
Peng Zou, Agnes Derecskei-Kovacs, and Simon W. North
pp 888 - 896;  

The Relation between Bond Lengths and Dissociation Energies of Carbon-Carbon 
Bonds
Andreas A. Zavitsas
pp 897 - 898;  

Trimethylene Sulfideˇˇˇ(HCl)n (n = 1, 2) Complexes: A Theoretical Study
H. Valde's and J. A. Sordo
pp 899 - 907; 

Conformational Properties of 2-Fluoroanisole in the Gas Phase
Vladimir P. Novikov, Lev V. Vilkov, and Heinz Oberhammer
pp 908 - 913; 

Theoretical Study of the SC3Hm+ Systems, m = {3, 4}
Francisco J. Go'mez and Jesu's R. Flores
pp 914 - 935; 

GENERAL PHYSICAL CHEMISTRY

Diffusion of Sucrose and , -Trehalose in Aqueous Solutions
Nancy Ekdawi-Sever, Juan J. de Pablo, Emily Feick, and Ernst von Meerwall
pp 936 - 943;  

Photolysis of Compressed Sodium Azide (NaN3) as a Synthetic Pathway to Nitrogen Materials
Suhithi M. Peiris and Thomas P. Russell
pp 944 - 947; 

ADDITIONS AND CORRECTIONS


Effects of Molecular Structure and Hydrogen Bonding on the Radiationless 
Deactivation of Singlet Excited Fluorenone Derivatives.
La'szlo' Biczo'k, Tibor Be'rces, and Haruo Inoue
pp 948 - 948;