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High quality research in physical chemistry, chemical physics and biophysical chemistry.
Contents list for Physical Chemistry Chemical Physics, issue 46, 2009
Front cover
Phys. Chem. Chem. Phys., 2009, 11, 10741
DOI: 10.1039/b923051n
Contents and Highlights in Chemical Technology
Phys. Chem. Chem. Phys., 2009, 11, 10743
DOI: 10.1039/b923052c
Review
Density functional theory for transition metals and transition metal chemistry
Christopher J. Cramer and Donald G. Truhlar,
Phys. Chem. Chem. Phys., 2009, 11, 10757
DOI: 10.1039/b907148b
Communications
Homogeneous ruthenium-based water–gas shift catalysts via supported ionic liquid phase (SILP) technology at low temperature and ambient pressure
Sebastian Werner, Normen Szesni, Richard W. Fischer, Marco Haumann and Peter Wasserscheid,
Phys. Chem. Chem. Phys., 2009, 11, 10817
DOI: 10.1039/b912688k
Melting of a tetrahedral network model of silica
R. Cabriolu, M. G. Del Pópolo and P. Ballone,
Phys. Chem. Chem. Phys., 2009, 11, 10820
DOI: 10.1039/b913358e
An experimental confirmation of the products of the reaction between CN radicals and NH3
Mark A. Blitz, Paul W. Seakins and Ian W. M. Smith,
Phys. Chem. Chem. Phys., 2009, 11, 10824
DOI: 10.1039/b917734e
Observation of a microcrystalline gel in colloids with competing interactions
Tian Hui Zhang, Jan Groenewold and Willem K. Kegel,
Phys. Chem. Chem. Phys., 2009, 11, 10827
DOI: 10.1039/b917254h
Papers
Anomalous length and voltage dependence of single molecule conductance
Wolfgang Haiss, Santiago Martin, Lisa E. Scullion, Laurent Bouffier, Simon J. Higgins and Richard J. Nichols,
Phys. Chem. Chem. Phys., 2009, 11, 10831
DOI: 10.1039/b910194b
Parameterizations for ice nucleation in biological and atmospheric systems
Thomas Koop and Bernhard Zobrist,
Phys. Chem. Chem. Phys., 2009, 11, 10839
DOI: 10.1039/b914289d
Physical properties of nanocomposites prepared by in situ polymerization of high-density polyethylene on multiwalled carbon nanotubes
Jihun Kim, Soon Man Hong, Soonjong Kwak and Yongsok Seo,
Phys. Chem. Chem. Phys., 2009, 11, 10851
DOI: 10.1039/b913527h
Fluid dynamics of evolving foams
Raquel Verdejo, Francisco J. Tapiador, Lukas Helfen, M. Mar Bernal, Natacha Bitinis and Miguel A. Lopez-Manchado,
Phys. Chem. Chem. Phys., 2009, 11, 10860
DOI: 10.1039/b913262g
The Jahn–Teller and pseudo-Jahn–Teller effects in the low-lying electronic states of 1,3,5-trifluorobenzene radical cation
T. Mondal and S. Mahapatra,
Phys. Chem. Chem. Phys., 2009, 11, 10867
DOI: 10.1039/b913342a
A model for the response towards oxidizing gases of photoactivated sensors based on individual SnO2 nanowires
Joan Daniel Prades, Roman Jimenez-Diaz, Marta Manzanares, Francisco Hernandez-Ramirez, Albert Cirera, Albert Romano-Rodriguez, Sanjay Mathur and Joan Ramon Morante,
Phys. Chem. Chem. Phys., 2009, 11, 10881
DOI: 10.1039/b915646a
Polyelectrolyte compaction by pH-responsive agents
A. F. Jorge, J. M. G. Sarraguça, R. S. Dias and A. A. C. C. Pais,
Phys. Chem. Chem. Phys., 2009, 11, 10890
DOI: 10.1039/b914159f
A low energy pathway to CuCl2 at Cu(110) surfaces
Albert F. Carley, Philip R. Davies, Krishnan R. Harikumar and Rhys V. Jones,
Phys. Chem. Chem. Phys., 2009, 11, 10899
DOI: 10.1039/b914970h
Axle charge effects on photoinduced electron transfer processes in rotaxanes containing porphyrin and [60]fullerene
Hisahiro Sasabe, Atula S. D. Sandanayaka, Nobuhiro Kihara, Yoshio Furusho, Toshikazu Takata, Yasuyuki Araki and Osamu Ito,
Phys. Chem. Chem. Phys., 2009, 11, 10908
DOI: 10.1039/b913966d
Biphasic liquid mixtures of ionic liquids and polyethylene glycols
Héctor Rodríguez, María Francisco, Mustafizur Rahman, Ning Sun and Robin D. Rogers,
Phys. Chem. Chem. Phys., 2009, 11, 10916
DOI: 10.1039/b916990c
Emission enhancement within gold spherical nanocavity arrays
Bincy Jose, Ronald Steffen, Ute Neugebauer, Eoin Sheridan, Reena Marthi, Robert J. Forster and Tia E. Keyes,
Phys. Chem. Chem. Phys., 2009, 11, 10923
DOI: 10.1039/b908385e
First-principles study for vacancy-induced magnetism in nonmagnetic ferroelectric BaTiO3
D. Cao, M. Q. Cai, Yue Zheng and W. Y. Hu,
Phys. Chem. Chem. Phys., 2009, 11, 10934
DOI: 10.1039/b908058a
Femtosecond electron detachment of aqueous bromide studied by two and three pulse spectroscopy
Martin K. Fischer, Alfred Laubereau and Hristo Iglev,
Phys. Chem. Chem. Phys., 2009, 11, 10939
DOI: 10.1039/b913688f
Kinetic studies of atmospherically relevant silicon chemistry. Part II: Silicon monoxide reactions
Juan C. Gómez Martín, Mark A. Blitz and John M. C. Plane,
Phys. Chem. Chem. Phys., 2009, 11, 10945
DOI: 10.1039/b911745h
Theoretical study of carbon species on Pd(111): competition between migration of C atoms to the subsurface interlayer and formation of Cn clusters on the surface
Sergey M. Kozlov, Ilya V. Yudanov, Hristiyan A. Aleksandrov and Notker Rösch,
Phys. Chem. Chem. Phys., 2009, 11, 10955
DOI: 10.1039/b916855a
Second-order perturbation theory with complete and restricted active space reference functions applied to oligomeric unsaturated hydrocarbons
Abdul Rehaman Moughal Shahi, Christopher J. Cramer and Laura Gagliardi,
Phys. Chem. Chem. Phys., 2009, 11, 10964
DOI: 10.1039/b912607d
Morphology of SBA-15-directed by association processes and surface energies
Peter Linton, Juan-Carlos Hernandez-Garrido, Paul A. Midgley, Håkan Wennerström and Viveka Alfredsson,
Phys. Chem. Chem. Phys., 2009, 11, 10973
DOI: 10.1039/b913755f
Modeling molecular crystals formed by spin-active metal complexes by atom–atom potentials
Anton V. Sinitskiy, Andrei L. Tchougréeff, Andrei M. Tokmachev and Richard Dronskowski,
Phys. Chem. Chem. Phys., 2009, 11, 10983
DOI: 10.1039/b908321a
An explanation for the charge on water
s surface
Angus Gray-Weale and James K. Beattie,
Phys. Chem. Chem. Phys., 2009, 11, 10994
DOI: 10.1039/b901806a
Geometric and electronic characteristics of active sites on TiO2-supported Au nano-catalysts: insights from first principles
Siris Laursen and Suljo Linic,
Phys. Chem. Chem. Phys., 2009, 11, 11006
DOI: 10.1039/b912641d
On the ionization and dissociative photoionization of iodomethane: a definitive experimental enthalpy of formation of CH3I
Andras Bodi, Nicholas S. Shuman and Tomas Baer,
Phys. Chem. Chem. Phys., 2009, 11, 11013
DOI: 10.1039/b915400k
Kinetics and characterization of photoinduced long-lived electron–hole pair of p-terphenyl occluded in ZSM-5 zeolites. Effects of aluminium content and extraframework cation
Alain Moissette, Fatima Belhadj, Claude Brémard and Hervé Vezin,
Phys. Chem. Chem. Phys., 2009, 11, 11022
DOI: 10.1039/b914545a
Precipitation patterns with polygonal boundaries between electrolytes
Changwei Pan, Qingyu Gao, Jingxuan Xie, Yu Xia and Irving R. Epstein,
Phys. Chem. Chem. Phys., 2009, 11, 11033
DOI: 10.1039/b904445k
The reaction between propene and hydroxyl
Judit Zádor, Ahren W. Jasper and James A. Miller,
Phys. Chem. Chem. Phys., 2009, 11, 11040
DOI: 10.1039/b915707g
Modelling doped (Ni, Pd, Pt) sulfur–nitrolic systems as new motifs for storage of hydrogen
Ayan Datta,
Phys. Chem. Chem. Phys., 2009, 11, 11054
DOI: 10.1039/b915204k
Back matter
Phys. Chem. Chem. Phys., 2009, 11, 11060
DOI: 10.1039/b923054h
Back cover
Phys. Chem. Chem. Phys., 2009, 11, 11063
DOI: 10.1039/b923058k
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