Journal cover: Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics

High quality research in physical chemistry, chemical physics and biophysical chemistry.
Impact Factor 4.198 48 Issues per Year Indexed in MEDLINE and Web of Science
 
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Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP04441J, Paper
In a previous study, we reported a striking observation that photoinduced electron transfer (PET) from aniline (AN) to photoexcited coumarin 102 (C102) can be accelerated by adding an inert component...
 
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP03733B, Paper
Pulsed-laser heating of colloidal noble-metal nanoparticles in an aqueous solution induces morphological changes such as size reduction. However, the technique suffers disadvantages through polydispersed products. Here, we show that continuous-wave...
 
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03676J, Paper
High-pressure molecular dynamics simulations reveal the influence of the hydrophobic active-site cavity of HIV-1 protease on the pressure-induced dimer dissociation.
 
Amir Haji-Akbari, Ryan S. DeFever, Sapna Sarupria and Pablo G. Debenedetti
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03948C, Paper
An 850-molecule crystalline nucleus identified in simulations of a 5 nm film at 235 K showing liquid-like and solid-like molecules in blue and fuchsia, respectively.
 
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03997A, Communication
(PhSiO1.5)8,10,12 cages are bulky, electron withdrawing like CF3; yet self-brominate (60 °C), favoring ortho substitution: PhT8 (≈85%), PhT10 (≈75%) and PhT12 (60%).
 
Yee-Fun Lim, Chin Sheng Chua, Coryl Jing Jun Lee and Dongzhi Chi
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03241A, Paper
Cu2O and CuO thin films deposited by a sol–gel spin-coating process show promise for photocatalytic water splitting.
 
Lu Sun, Xin Li, Thomas Hede, Yaoquan Tu, Caroline Leck and Hans Ågren
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03423F, Paper
This figure represents the configuration of the marine gel after the polysaccharides undergo self-assembly. The calcium cations are blended inside the assembly and they act as ionic bridges.
 
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03389B, Paper
Different release mechanisms are identified in the temporal evolution of drug release from IPN-type hydrogels, conducted over longer timescales.
 
Hsin-Sheng Duan, Huanping Zhou, Qi Chen, Pengyu Sun, Song Luo, Tze-Bin Song, Brion Bob and Yang Yang
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP04479G, Communication
Thin film photovoltaic cells based on hybrid halide perovskite absorbers have emerged as promising candidates for next generation photovoltaics.
 
Jeremy Cain, Alexander Laskin, Mohammad Reza Kholghy, Murray J. Thomson and Hai Wang
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03330B, Paper
HR-MS speciation of young soot produced in a coflow diffusion flame reveal an array of ‘aliphatic’ and ‘aromatic’ CxHyOz constituents.
 
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP04112G, Perspective
The key aspects, opportunities and perspectives of quasielastic neutron scattering studies of proton conducting oxides are discussed.
 
Camille Latouche, Yan-Ru Lin, Yeny Tobon, Eric Furet, Jean-Yves Saillard, Chen-Wei Liu and Abdou Boucekkine
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03990D, Paper
Au–Au chemical bonding appears upon UV irradiation.
 
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP03709J, Paper
We present a hybrid three-dimensional (3D) theoretical approach, the density functional theory (DFT) integrated with the reference interaction site model (RISM), to investigate the nucleation of CO2 and CH4 hydrates....
 
Jens-Peter Eufinger, Maximilian Daniels, Kerstin Schmale, Stefan Berendts, Gregor Ulbrich, Martin Lerch, Hans-Dieter Wiemhöfer and Jürgen Janek
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03704A, Paper
Defect-chemistry of the oxygen storage compound CeO2–ZrO2–Y2O3 has been investigated with conductivity, EMF and non-stoichiometry measurements and the observed non-ideality was described by an unconventional defect-model.
 
Bao-Hua Mao, Rui Chang, Lei Shi, Qiqi Zhuo, Sana Rani, Xiaosong Liu, Eric C. Tyo, Stefan Vajda, Sui-Dong Wang and Zhi Liu
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP02325K, Paper
From themed collection Size Selected Clusters and Particles: From Physical Chemistry to Catalysis
We have investigated model systems of silver clusters with different sizes (3 and 15 atoms) deposited on alumina and titania supports using ambient pressure X-ray photoelectron spectroscopy. The electronic structures...
 
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP04643A, Communication
An azobenzene liquid-crystalline compound possessing two chiral centres at both peripheral ends of the molecular structure exhibits electric-field-induced birefringence in the isotropic liquid phase, which was found to be attributable...
 
Candelaria Inés Cámara, Lorena M.A. Monzon, J. M.D. Coey and Lidia Mabel YUDI
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP04464A, Paper
The interaction of Co hexagonal magnetic nanoparticles (MNPs) with disteroyl phosphatidyl glycerol (DSPG) and distearoyl phosphatidic acid (DSPA) films adsorbed at a water / 1,2-dichloroethane interface is studied employing cyclic...
 
Sangram Raut, Joseph D Kimball, Rafal Fudala, Hung Doan, Badri Maliwal, Nirupama Sabnis, Andras Lacko, Ignacy Gryzcynski, Sergei V Dzyuba and Zygmunt Gryczynski
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP04260C, Paper
Fluorescence properties of a novel homodimeric BODIPY dye rotor for Fluorescence Lifetime Imaging Microscopy (FLIM) are reported. Steady state and time resolved fluorescence measurements established the viscosity dependant behaviour in...
 
Yanmei Li, Xing Wang, Yanqun Shao, Dian Tang, Bo Wu, Zhongzhi Tang and Wei Lin
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP04131C, Paper
Phase diagram of Ru–Ce–O was calculated by a combination of ab initio density functional theory and thermodynamic calculations. The phase diagram indicates that the solubility between ruthenium oxide and cerium...
 
Andrei Filippov, Mamoun Taher, Faiz Ullah Shah, Sergei Glavatskih and Oleg N. Antzutkin
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP03996C, Paper
The physicochemical properties of ionic liquids are strongly affected by the selective combination of the cations and anions comprising the ionic liquid. In particular, the length of the ions’ alkyl...
 
Olaf Morawski, Andrzej L. Sobolewski, Boleslaw Kozankiewicz, Lech Sznitko and Andrzej Miniewicz
Phys. Chem. Chem. Phys., 2014, Accepted Manuscript
DOI: 10.1039/C4CP03634D, Paper
We study absorption and emission spectra of optically nonlinear single crystal of 3-(1,1-dicyanoethenyl)-1-phenyl-4,5-dihydro-1H-pyrazole (DCNP) at 5 K. We argue that fluorescence has complex origin, it is emitted from excitonic band,...
 
Dylan C. Hennessey, Brendan J. H. Sheppard, Dalton E. C. K. Mackenzie and Jason K. Pearson
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP02669A, Paper
We present electron pair distributions within chemical bonds and show that these characterize and quantify chemical bond strength.
 
George Volonakis, Leonidas Tsetseris and Stergios Logothetidis
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03203A, Paper
The atomic-scale details of oxygen and water adsorption inside poly(3-hexylthiophene) (P3HT) crystals are revealed. Stable impurity-related configurations are associated with distinct effects on the electronic properties of the defective material.
 
Chunmei Wu, Seyed Hadi Zandavi and C. A. Ward
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03585B, Paper
We use the Zeta adsorption isotherm and propose a method for determining the conditions at which an adsorbed vapour becomes an adsorbed liquid.
 
Phys. Chem. Chem. Phys., 2014, Advance Article
DOI: 10.1039/C4CP03302G, Paper
Ab initio molecular dynamics simulations of carbonic acid (H2CO3) at the air–water interface yield a lower dissociation barrier than in bulk water.
 

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