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Contents list for Physical Chemistry Chemical Physics, issue 39, 2009
Front cover
Phys. Chem. Chem. Phys., 2009, 11, 8641
DOI: 10.1039/b919320k
Inside front cover
Phys. Chem. Chem. Phys., 2009, 11, 8642
DOI: 10.1039/b919321a
Contents and Highlights in Chemical Science
Phys. Chem. Chem. Phys., 2009, 11, 8643
DOI: 10.1039/b919323p
Perspective
Modelling energy level alignment at organic interfaces and density functional theory
F. Flores, J. Ortega and H. Vázquez,
Phys. Chem. Chem. Phys., 2009, 11, 8658
DOI: 10.1039/b902492c
Communications
Identification of valence electronic states of aqueous acetic acid in acid–base equilibrium using site-selective X-ray emission spectroscopy
Yuka Horikawa, Takashi Tokushima, Yoshihisa Harada, Osamu Takahashi, Ashish Chainani, Yasunori Senba, Haruhiko Ohashi, Atsunari Hiraya and Shik Shin,
Phys. Chem. Chem. Phys., 2009, 11, 8676
DOI: 10.1039/b910039c
FTIR study on the light sensitivity of the [NiFe] hydrogenase from Desulfovibrio vulgaris Miyazaki F: Ni–C to Ni–L photoconversion, kinetics of proton rebinding and H/D isotope effect
Petra Kellers, Maria-Eirini Pandelia, Leslie J. Currell, Helmut Görner and Wolfgang Lubitz,
Phys. Chem. Chem. Phys., 2009, 11, 8680
DOI: 10.1039/b913635e
Nanoscale heterogeneity and light-emission dynamics in solution-processed phosphorescent organic light-emitting devices
Yasuhiro Sekiguchi, Satoshi Habuchi and Martin Vacha,
Phys. Chem. Chem. Phys., 2009, 11, 8684
DOI: 10.1039/b913401h
Papers
Conformational properties of six-membered heterocycles: accurate relative energy differences with DFT, the importance of dispersion interactions and silicon substitution effects
Ragnar Bjornsson and Ingvar Arnason,
Phys. Chem. Chem. Phys., 2009, 11, 8689
DOI: 10.1039/b910016d
Local variations in defect polarization and covalent bonding in ferroelectric Cu2+-doped PZT and KNN functional ceramics at the morphotropic phase boundary
Rüdiger-A. Eichel, Ebru Erünal, Michael D. Drahus, Donald M. Smyth, Johan van Tol, Jérôme Acker, Hans Kungl and Michael J. Hoffmann,
Phys. Chem. Chem. Phys., 2009, 11, 8698
DOI: 10.1039/b905642d
A comprehensive investigation of the electronic spectral and photophysical properties of conjugated naphthalene–thiophene oligomers
Joăo Pina and J. Sérgio Seixas de Melo,
Phys. Chem. Chem. Phys., 2009, 11, 8706
DOI: 10.1039/b909113k
Formation and characterization of the CuO5, CuO4 and CuO4- complexes in solid argon
Yu Gong and Mingfei Zhou,
Phys. Chem. Chem. Phys., 2009, 11, 8714
DOI: 10.1039/b909999a
The origin of the large bending enhancement of the reaction of C2H2+ with methane: the effects of bending momentum, ruling out the precursor mechanism, and steps toward 
Polanyi rules
for polyatomic reactions
Jianbo Liu and Scott L. Anderson,
Phys. Chem. Chem. Phys., 2009, 11, 8721
DOI: 10.1039/b908328f
Multiphoton ionization/dissociation dynamics of formyl fluoride by velocity mapping ion imaging
Fengyan Wang, Yongwei Zhang, Hua Wang, Jie Liu, Bo Jiang, Xiuyan Wang and Xueming Yang,
Phys. Chem. Chem. Phys., 2009, 11, 8733
DOI: 10.1039/b903688a
Nanoconfinement effects in the self-assembly of diindenoperylene (DIP) on Cu(111) surfaces
Dimas G. de Oteyza, Esther Barrena, Helmut Dosch and Yutaka Wakayama,
Phys. Chem. Chem. Phys., 2009, 11, 8741
DOI: 10.1039/b903116b
Nanoclusters of room temperature ionic liquids: a molecular dynamics simulation study
S.S. Sarangi, B.L. Bhargava and S. Balasubramanian,
Phys. Chem. Chem. Phys., 2009, 11, 8745
DOI: 10.1039/b908339a
Gas phase fragmentation of protonated betaine and its clusters
Jean Ann Wyer, Linda Feketeová, Steen Brřndsted Nielsen and Richard A. J. O
Hair,
Phys. Chem. Chem. Phys., 2009, 11, 8752
DOI: 10.1039/b909653a
Enhanced acidity of cyclopenta-2,4-dienylborane and its Al and Ga analogues. The role of aromatization
Marcela Hurtado, Manuel Yáńez and Jean-Claude Guillemin,
Phys. Chem. Chem. Phys., 2009, 11, 8759
DOI: 10.1039/b906045f
A porphyrin–polyoxometallate bio-inspired mimic for artificial photosynthesis
Kristopher J. Elliott, Anthony Harriman, Loďc Le Pleux, Yann Pellegrin, Errol Blart, Cédric R. Mayer and Fabrice Odobel,
Phys. Chem. Chem. Phys., 2009, 11, 8767
DOI: 10.1039/b905548g
Enhanced photoluminescence of Eu3+ induced by energy transfer from In2O3 nano-crystals embedded in glassy matrix
Yunlong Yu, Daqin Chen, Yuansheng Wang, Ping Huang, Fangyi Weng and Mutong Niu,
Phys. Chem. Chem. Phys., 2009, 11, 8774
DOI: 10.1039/b907065f
Structural changes of noble metal catalysts during ignition and extinction of the partial oxidation of methane studied by advanced QEXAFS techniques
Jan-Dierk Grunwaldt, Matthias Beier, Bertram Kimmerle, Alfons Baiker, Maarten Nachtegaal, Bernd Griesebock, Dirk Lützenkirchen-Hecht, Jan Stötzel and Ronald Frahm,
Phys. Chem. Chem. Phys., 2009, 11, 8779
DOI: 10.1039/b909872k
The potential role of hydrogen bonding in aprotic and protic ionic liquids
Koichi Fumino, Alexander Wulf and Ralf Ludwig,
Phys. Chem. Chem. Phys., 2009, 11, 8790
DOI: 10.1039/b905634c
Effect of carotenoid structure on excited-state dynamics of carbonyl carotenoids
Pavel Chábera, Marcel Fuciman, Petr H
íbek and Tomá
Polívka,
Phys. Chem. Chem. Phys., 2009, 11, 8795
DOI: 10.1039/b909924g
Depolarisation of rotational orientation and alignment in OH (X2
) + Xe collisions
Grant Paterson, Sarandis Marinakis, Jacek K
os, Matthew L. Costen and Kenneth G. McKendrick,
Phys. Chem. Chem. Phys., 2009, 11, 8804
DOI: 10.1039/b909050a
Depolarisation of rotational orientation and alignment of OH (X2) in collisions with molecular partners: N2 and O2
Grant Paterson, Sarandis Marinakis, Matthew L. Costen and Kenneth G. McKendrick,
Phys. Chem. Chem. Phys., 2009, 11, 8813
DOI: 10.1039/b909051g
Molecular dynamics simulation of 13C NMR powder lineshapes of CO in structure I clathrate hydrate
H. Mohammadi-Manesh, Saman Alavi, Tom K. Woo, Mahmud Ashrafizaadeh and Bijan Najafi,
Phys. Chem. Chem. Phys., 2009, 11, 8821
DOI: 10.1039/b905233j
Fluorescence XAFS study of NaAlH4 doped with a Ce-based precursor
Aline Léon, Jörg Rothe, Krzysztof Chopek, Oleg Zabara and Maximilian Fichtner,
Phys. Chem. Chem. Phys., 2009, 11, 8829
DOI: 10.1039/b903272j
Controlling the growth behaviour of multilayered films via layer-by-layer assembly with multiple interactions
Cao Li, Jing Zhang, Shuo Yang, Bo-Lan Li, Yong-Yong Li, Xian-Zheng Zhang and Ren-Xi Zhuo,
Phys. Chem. Chem. Phys., 2009, 11, 8835
DOI: 10.1039/b906306d
Temporal patterning of the potential induced by localized corrosion of iron passivity in acid media. Growth and breakdown of the oxide film described in terms of a point defect model
Dimitra Sazou, Maria Pavlidou and Michael Pagitsas,
Phys. Chem. Chem. Phys., 2009, 11, 8841
DOI: 10.1039/b906488e
Adsorption of dioxygen to copper in CuHY zeolite
Shampa Santra, Tanja Archipov, Augusta B. Ene, Helena Komnik, Hermann Stoll, Emil Roduner and Guntram Rauhut,
Phys. Chem. Chem. Phys., 2009, 11, 8855
DOI: 10.1039/b904152d
Bis(terpyridine)-based surface template structures on graphite: a force field and DFT study
Daniela Künzel, Thomas Markert, Axel Groß and David M. Benoit,
Phys. Chem. Chem. Phys., 2009, 11, 8867
DOI: 10.1039/b907443k
Association and electrostatic steering of 
-lactalbumin–lysozyme heterodimers
Björn A. Persson and Mikael Lund,
Phys. Chem. Chem. Phys., 2009, 11, 8879
DOI: 10.1039/b909179c
Photoinduced hole-transfer in semiconducting polymer/low-bandgap cyanine dye blends: evidence for unit charge separation quantum yield
Fernando A. Castro, Hadjar Benmansour, Jacques-E. Moser, Carlos F. O. Graeff, Frank Nüesch and Roland Hany,
Phys. Chem. Chem. Phys., 2009, 11, 8886
DOI: 10.1039/b909512h
Proton/calcium ion exchange behavior of calcite
Adrián Villegas-Jiménez, Alfonso Mucci and Jeanne Paquette,
Phys. Chem. Chem. Phys., 2009, 11, 8895
DOI: 10.1039/b815198a
To probe the structure of methanol and Aerosol OT (AOT) in AOT reverse micelles by FTIR measurements
Palash Setua, Debabrata Seth and Nilmoni Sarkar,
Phys. Chem. Chem. Phys., 2009, 11, 8913
DOI: 10.1039/b818021k
Macromolecular hydration compared with preferential hydration and their role on macromolecule-osmolyte coupled diffusion
Huixiang Zhang and Onofrio Annunziata,
Phys. Chem. Chem. Phys., 2009, 11, 8923
DOI: 10.1039/b910152g
Substantial difference between temperature dependencies of dsDNA predenaturation process obtained by voltammetry and spectroscopy
Ewelina Zabost, Anna Maria Nowicka, Mikolaj Donten and Zbigniew Stojek,
Phys. Chem. Chem. Phys., 2009, 11, 8933
DOI: 10.1039/b906752c
1-Alkyl-3-methylimidazolium alkanesulfonate ionic liquids, [CnH2n+1mim][CkH2k+1SO3]: synthesis and physicochemical properties
Marijana Blesic, Magorzata Swad
ba-Kwa
ny, Tayeb Belhocine, H. Q. Nimal Gunaratne, José N. Canongia Lopes, Margarida F. Costa Gomes, Agílio A. H. Pádua, Kenneth R. Seddon and Luís Paulo N. Rebelo,
Phys. Chem. Chem. Phys., 2009, 11, 8939
DOI: 10.1039/b910177m
Synthesis and characterization of FePd magnetic nanoparticles modified with chiral BINAP ligand as a recoverable catalyst vehicle for the asymmetric coupling reaction
Kohsuke Mori, Yuichi Kondo and Hiromi Yamashita,
Phys. Chem. Chem. Phys., 2009, 11, 8949
DOI: 10.1039/b910069e
Back cover
Phys. Chem. Chem. Phys., 2009, 11, 8955
DOI: 10.1039/b919324n
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