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Physical Chemistry Chemical Physics

High quality research in physical chemistry, chemical physics and biophysical chemistry.



Contents list for Physical Chemistry Chemical Physics, issue 15, 2005

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Front cover
Phys. Chem. Chem. Phys., 2005, 7, 2841
DOI: 10.1039/b509550f

front cover image for Physical Chemistry Chemical Physics, Issue 15, 2005


Contents
Phys. Chem. Chem. Phys., 2005, 7, 2843
DOI: 10.1039/b509551b

Editorial

Crossing the boundaries with Soft Matter
Phys. Chem. Chem. Phys., 2005, 7, 2849
DOI: 10.1039/b507834m

Communications

Growth of crystalline rubrene films with enhanced stability
D. Käfer and G. Witte,  Phys. Chem. Chem. Phys., 2005, 7, 2850
DOI: 10.1039/b507620j

Half or full core hole in density functional theory X-ray absorption spectrum calculations of water?
Matteo Cavalleri, Michael Odelius, Dennis Nordlund, Anders Nilsson and Lars G. M. Pettersson,  Phys. Chem. Chem. Phys., 2005, 7, 2854
DOI: 10.1039/b505723j

Invited Article

The scanned nanopipette: a new tool for high resolution bioimaging and controlled deposition of biomolecules
Liming Ying, Andreas Bruckbauer, Dejian Zhou, Julia Gorelik, Andrew Shevchuk, Max Lab, Yuri Korchev and David Klenerman,  Phys. Chem. Chem. Phys., 2005, 7, 2859
DOI: 10.1039/b506743j

Papers

THEORETICAL STUDIES AND METHODS

Repulsive double many-body expansion potential energy surface for the reactions N(4S)+ H2 NH(X3)+ H from accurate ab initio calculations
L. A. Poveda and A. J. C. Varandas,  Phys. Chem. Chem. Phys., 2005, 7, 2867
DOI: 10.1039/b505590c

Distorted five-fold coordination of Cu2+(aq) from a Car–Parrinello molecular dynamics simulation
Sami Amira, Daniel Spĺngberg and Kersti Hermansson,  Phys. Chem. Chem. Phys., 2005, 7, 2874
DOI: 10.1039/b502427g

Accurate ab initio determination of spectroscopic and thermochemical properties of mono- and dichlorocarbenes
György Tarczay, Terry A. Miller, Gábor Czakó and Attila G. Császár,  Phys. Chem. Chem. Phys., 2005, 7, 2881
DOI: 10.1039/b506790a

SPECTROSCOPY

Structure and dynamics of the triplet state of oligothiophenes in isotropic and partially oriented matrices
Antonio Barbon, Marco Bortolus, Anna Lisa Maniero and Marina Brustolon,  Phys. Chem. Chem. Phys., 2005, 7, 2894
DOI: 10.1039/b505209b

KINETICS AND REACTION DYNAMICS

Time-resolved gas-phase kinetic and quantum chemical studies of the reaction of silylene with oxygen
Rosa Becerra, Sarah-Jane Bowes, J. Steven Ogden, J. Pat Cannady, Ivana Adamovic, Mark. S Gordon, Matthew J. Almond and Robin Walsh,  Phys. Chem. Chem. Phys., 2005, 7, 2900
DOI: 10.1039/b504760a

High-spin to low-spin relaxation kinetics in the [Fe(TRIM)2]Cl2 complex
Sébastien Bonhommeau, Nicolas Bréfuel, Villö K. Pálfi, Gábor Molnár, Antoine Zwick, Lionel Salmon, Jean-Pierre Tuchagues, José Sanchez Costa, Jean-François Létard, Hauke Paulsen and Azzedine Bousseksou,  Phys. Chem. Chem. Phys., 2005, 7, 2909
DOI: 10.1039/b504614a

On one dimensional chemical diode and frequency generator constructed with an excitable surface reaction
J. Gorecka and J. Gorecki,  Phys. Chem. Chem. Phys., 2005, 7, 2915
DOI: 10.1039/b504621a

Kinetic measurements on methylidyne radical reactions with several hydrocarbons at low temperatures
Nicolas Daugey, Philippe Caubet, Bertrand Retail, Michel Costes, Astrid Bergeat and Gérard Dorthe,  Phys. Chem. Chem. Phys., 2005, 7, 2921
DOI: 10.1039/b506096f

STATISTICAL MECHANICS AND THERMODYNAMICS

Surface tension of a Lennard-Jones liquid under supersaturation
Songnian He and Phil Attard,  Phys. Chem. Chem. Phys., 2005, 7, 2928
DOI: 10.1039/b507106b

NANOSCIENCES

Oxidising CO to CO2 using ceria nanoparticles
Thi X. T. Sayle, Stephen C. Parker and Dean C. Sayle,  Phys. Chem. Chem. Phys., 2005, 7, 2936
DOI: 10.1039/b506359k

SURFACES AND INTERFACES

Angle resolved ion scattering spectroscopy at surfaces of pure liquids: topography and orientation of molecules
Gunther Andersson,  Phys. Chem. Chem. Phys., 2005, 7, 2942
DOI: 10.1039/b504133c

Angle resolved ion scattering spectroscopy reveals the local topography around atoms in a liquid surface
Gunther Andersson, Thomas Krebs and Harald Morgner,  Phys. Chem. Chem. Phys., 2005, 7, 2948
DOI: 10.1039/b505965h

Scanning electrochemical microscopy as a probe of Ag+ binding kinetics at Langmuir phospholipid monolayers
David P. Burt, Javier Cervera, Daniel Mandler, Julie V. Macpherson, José A. Manzanares and Patrick R. Unwin,  Phys. Chem. Chem. Phys., 2005, 7, 2955
DOI: 10.1039/b506611e

MATERIALS AND MACROMOLECULES

Density functional study of infinite polyserine chains
F. Bogár, Zs. Szekeres, F. Bartha, B. Penke and J. Ladik,  Phys. Chem. Chem. Phys., 2005, 7, 2965
DOI: 10.1039/b504488j

Thermotropic phase behaviour of long-chain alkylmaltosides
Caroline A. Ericsson, Louise C. Ericsson, Vitaly Kocherbitov, Olle Söderman and Stefan Ulvenlund,  Phys. Chem. Chem. Phys., 2005, 7, 2970
DOI: 10.1039/b502922h

Back matter
Phys. Chem. Chem. Phys., 2005, 7, 2978
DOI: 10.1039/b509554a

Back cover
Phys. Chem. Chem. Phys., 2005, 7, 2979
DOI: 10.1039/b509555g