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Journal cover: Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics

High quality research in physical chemistry, chemical physics and biophysical chemistry.
Impact Factor 4.493 48 Issues per Year Indexed in Medline and Web of Science
 
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Jose A Alarco, Peter Cade Talbot and Ian Donald Richard Mackinnon
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP04402B, Paper
We show that the well-known Kohn anomaly predicts Tc for ordered AlB2-type structures. We use ab initio Density Functional Theory to calculate phonon dispersions for Mg1-xAlxB2 compositions and identify a...
 
M. T. Viciosa, G. Santos, A. Costa, F. Danède, L. C. Branco, N. Jordão, N. T. Correia and M. Dionísio
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP03715H, Paper
It was demonstrated that the combination of the almost water insoluble active pharmaceutical ingredient (API) ibuprofen with the biocompatible 1-ethanol-3-methylimidazolium [C2OHMIM] cation of an ionic liquid (IL) leads to a highly water miscible IL-API with a solubility increased by around 5 orders of magnitude.
 
Remco Hartkamp, Bertrand Siboulet, Jean-François Dufrêche and Benoit Coasne
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP03818A, Paper
Monovalent and divalent aqueous electrolytes confined in negatively charged porous silica are studied by means of molecular simulation including free energy calculations. Owing to the strong cation adsorption at the...
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP90155C, Editorial
From themed collection Optical spectroscopy coupled with mass spectrometry methods
This themed issue reports on recent progress in the fast developing field of spectroscopy of ions by means of mass spectrometry coupled with optical spectroscopy. It focuses on both the experimental and theoretical aspects of this topic.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP03469H, Paper
High efficiency and stable blue phosphorescent organic light-emitting diodes were developed using host materials derived from the bicarbazole backbone structure.
 
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP04908C, Paper
Structure and dynamics of an antigen-antibody complex are monitored by circular dichroism (CD) spectroscopy, fluorescence correlation spectroscopy (FCS) and single molecule FRET (smFRET). In this work, the antigen is enhanced...
 
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP04125B, Paper
A series of novel organic–inorganic nanoscale layered materials were synthesized by intercalating Ti–containing schiff base complex into the interlayer of the ZnM layered double hydroxides (LDHs, M=Al, Cr, Fe, Ce)....
 
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP03937A, Paper
A novel series of donor-acceptor-donor (D-A-D) structured pyridine derivatives were synthesised and detailed photo-physical investigations made using mainly steady-state and time-resolved spectroscopy techniques at varying temperatures. The investigations showed that...
 
Anthony Harriman, Patrycja Stachelek, Raymond Ziessel and alexandra Sutter
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP03932K, Paper
An extended molecular array, comprising three distinct types of chromophore and two additional redox-active subunits, that harvests photons over most of the visible spectral range has been synthesized and characterised....
 
Mark Greiner, Travis E Jones, Benjamin E Johnson, Tulio C. R. Rocha, Zhu-Jun Wang, Marc Armbrüster, Marc Georg Willinger, Axel Knop-Gericke and Robert Schlögl
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP03722K, Paper
The oxidation of copper catalysts during ethylene epoxidation was characterized using in-situ photoemission spectroscopy and electron microscopy. Gas chromatography, proton-transfer reaction mass spectrometry and electron-ionization mass spectrometry were used to...
 
Daniele Mammoli, Nicola Salvi, Jonas Milani, Roberto Buratto, Aurélien Bornet, Akansha Ashvani Sehgal, Estel Canet, Philippe Pelupessy, Diego Carnevale, Sami Jannin and Geoffrey Bodenhausen
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP03350K, Paper
Para-water is an analogue of para-hydrogen, where the two proton spins are in a quantum state that is antisymmetric under permutation, also known as singlet state. The populations of the...
 
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP02841H, Paper
Ionic liquids (ILs) have shown great potential in dissolution and stability of biomolecules when a low-to-moderate quantity of water is added. Hence, determining the thermophysical properties and understanding these novel...
 
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP04462F, Paper
We study the correlation of wetting properties and corrosion rates on hydrophobized cast iron. Samples of different surface roughness (abraded by sandpaper) are studied without coating and with two types...
 
Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP04189A, Paper
The chabazite-type silicoaluminophosphate SAPO-34 is a promising adsorbent for applications in thermal energy storage using water adsorption-desorption cycles. In order to develop a microscopic understanding of the impact of local...
 
Karina Kubiak-Ossowska, Monika Cwieka, Agnieszka Kaczynska, Barbara Jachimska and Paul A. Mulheran
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP03910J, Paper
MD simulations and experiments (MP-SPR, contact angle and zeta potential measurements) give a comprehensive overview of HEWL adsorption on silica.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP03842A, Communication
The hexamer (CO2)4–(C2H2)2 is characterized by its high-resolution infrared spectrum.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP04483A, Paper
The influence of temperature on the PL properties of silicon quantum dots (Si QDs) as a function of pH and excitation wavelength has been investigated to understand the role of surface amine groups and the bandgap of allylamine-capped Si QDs.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP03803K, Paper
By pre-spin-coating a perovskite precursor solution, increased perovskite capacity in the mesoporous structure, enhanced electron injection and more charge transport pathways are realized.
 
Kohsuke Mori, Taiki Itoh, Hiroki Kakudo, Tomoyuki Iwamoto, Yoichi Masui, Makoto Onaka and Hiromi Yamashita
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP04493F, Paper
The combination of an active Ni site and thiazole orange photosensitizer on g-C3N4 enables visible-light-driven H2 production in aqueous media.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP04278J, Paper
The QCT calculations based on an accurate global full-dimensional PES are capable of reproducing the experimental dynamic features for O(1D) + CH4.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP03885E, Paper
A pentagonal B2C monolayer shows flexible structural and electronic properties under external strain.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP02987B, Paper
A linewidth correction method was introduced, which enables the measurement of biomolecule CCSs in FT-ICR cells at 10−10 Torr.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP02828K, Paper
The kinetics of γ-radiation-induced Co3O4 nanoparticle formation occurs in four distinct stages. Scavengers and [Co2+]0 affect the kinetics in different stages, and consequently influence the final particle sizes. Radiolysis model calculations on the effects of radical scavengers provide insights into their role in controlling particle formation.
 
P. Bolognesi, J. A. Kettunen, A. Cartoni, R. Richter, S. Tosic, S. Maclot, P. Rousseau, R. Delaunay and L. Avaldi
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP02601F, Paper
The fragmentation of the 2Br-pyrimidine molecule following direct valence photoionization or inner shell excitation has been studied by electron–ion coincidence experiments.
 
Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP04314J, Paper
Solar water splitting may be improved by reduced charge carrier mass in Fe2O3 covered with Pt.
 

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