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Contents list for Physical Chemistry Chemical Physics, issue 23, 2005
Front cover
Phys. Chem. Chem. Phys., 2005, 7, 3897
DOI: 10.1039/b515592b
Contents
Phys. Chem. Chem. Phys., 2005, 7, 3899
DOI: 10.1039/b515595a
Communication
Direct observation of size dependent activation of NO on gold clusters
André Fielicke, Gert von Helden, Gerard Meijer, Benoit Simard and David M. Rayner,
Phys. Chem. Chem. Phys., 2005, 7, 3906
DOI: 10.1039/b511710k
Invited Article
Parallel tempering: Theory, applications, and new perspectives
David J. Earl and Michael W. Deem,
Phys. Chem. Chem. Phys., 2005, 7, 3910
DOI: 10.1039/b509983h
Papers
THEORETICAL STUDIES AND METHODS
A short-range gradient-corrected density functional in long-range coupled-cluster calculations for rare gas dimers
Erich Goll, Hans-Joachim Werner and Hermann Stoll,
Phys. Chem. Chem. Phys., 2005, 7, 3917
DOI: 10.1039/b509242f
Ab initio calculation of electronic absorption spectra and ionization potentials of C3H3 radicals
Wolfgang Eisfeld,
Phys. Chem. Chem. Phys., 2005, 7, 3924
DOI: 10.1039/b511343a
Ab initio study of temporary anions of benzene and fluorobenzenes using the multipartitioning many-body perturbation theory
Artur F. Izmaylov, Lyudmila N. Shchegoleva, Gustavo E. Scuseria and Andréi Zaitsevskii,
Phys. Chem. Chem. Phys., 2005, 7, 3933
DOI: 10.1039/b509805j
Multireference calculations of the fluorescence, phosphorescence and photodissociation of p-chlorotoluene
Ya-Jun Liu and Sten Lunell,
Phys. Chem. Chem. Phys., 2005, 7, 3938
DOI: 10.1039/b510601j
Bending effect on the stabilities of quadruple hydrogen bonding systems: theoretical study of a series of self-constituted quadruple hydrogen bonded complexes (C9H9N5O2)2
Wen-Lan Liu and Guang-Ju Chen,
Phys. Chem. Chem. Phys., 2005, 7, 3943
DOI: 10.1039/b511228a
Theoretical maximal storage of hydrogen in zeolitic frameworks
Jenny G. Vitillo, Gabriele Ricchiardi, Giuseppe Spoto and Adriano Zecchina,
Phys. Chem. Chem. Phys., 2005, 7, 3948
DOI: 10.1039/b510989b
SPECTROSCOPY
Missing levels lead to additional lines: the influence of nuclear spin statistics on femtosecond degenerate four wave mixing spectroscopy of polyatomic systems
C. Riehn, M. I. Kunitski, V. V. Matylitsky, M. F. Gelin and B. Brutschy,
Phys. Chem. Chem. Phys., 2005, 7, 3955
DOI: 10.1039/b510363k
KINETICS AND REACTION DYNAMICS
Ultrafast dynamics of excess electrons in molten salts: Part II. Femtosecond investigations of Na–NaBr and Na–NaI melts
H. Brands, N. Chandrasekhar, H. Hippler and A.-N. Unterreiner,
Phys. Chem. Chem. Phys., 2005, 7, 3963
DOI: 10.1039/b511392j
Uptake of Fe, Na and K atoms on low-temperature ice: implications for metal atom scavenging in the vicinity of polar mesospheric clouds
Benjamin J. Murray and John M. C. Plane,
Phys. Chem. Chem. Phys., 2005, 7, 3970
DOI: 10.1039/b508846a
Mechanistic and kinetic study of the O + CH3OCH2 reaction and the unimolecular decomposition of CH3OCH2O
Xinli Song, Hua Hou and Baoshan Wang,
Phys. Chem. Chem. Phys., 2005, 7, 3980
DOI: 10.1039/b510459a
SURFACES AND INTERFACES
Identification of possible Lewis acid sites on the 
-AlF3(100) surface: an ab initio total energy study
Adrian Wander, Christine L. Bailey, Barry G. Searle, Sanghamitra Mukhopadhyay and Nicholas M. Harrison,
Phys. Chem. Chem. Phys., 2005, 7, 3989
DOI: 10.1039/b509845a
Adsorption of triblock copolymers and their homopolymers at laponite clay/solution interface. Role played by the copolymer nature
R. De Lisi, G. Lazzara, R. Lombardo, S. Milioto, N. Muratore and M. L. Turco Liveri,
Phys. Chem. Chem. Phys., 2005, 7, 3994
DOI: 10.1039/b510891h
BIOPHYSICAL CHEMISTRY
Binding of a chiral drug to a protein: an investigation of the 2-(3-benzoylphenyl)propionic acid/bovine serum albumin system by circular dichroism and fluorescence
Sandra Monti, Francesco Manoli, Salvatore Sortino, Raffaele Morrone and Giovanni Nicolosi,
Phys. Chem. Chem. Phys., 2005, 7, 4002
DOI: 10.1039/b509911k
Energy dissipation in slipping biological pumps
Signe Kjelstrup, J. Miguel Rubi and Dick Bedeaux,
Phys. Chem. Chem. Phys., 2005, 7, 4009
DOI: 10.1039/b511990a
CATALYSIS
Reverse hydrogen spillover in supported subnanosize clusters of the metals of groups 8 to 11. A computational model study
Georgi N. Vayssilov and Notker Rösch,
Phys. Chem. Chem. Phys., 2005, 7, 4019
DOI: 10.1039/b511842e
Back cover
Phys. Chem. Chem. Phys., 2005, 7, 4027
DOI: 10.1039/b515596g
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