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Synthesis of functional xLayMn/KIT-6 and features in hot coal gas...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02256H, PaperHong Xia, Fengmei Zhang, Zhaofei Zhang, Bingsi LiuA 3La97Mn/KIT-6 sorbent showed excellent performance for hot coal gas...
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A theoretical study of potentially observable chirality-sensitive NMR effects...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02870A, PaperPiotr Garbacz, Janusz Cukras, Michal JaszunskiDerivatives of fluorocyclopropene have large antisymmetric parts of the...
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Luminescence and fine structure correlation in ZnO permeated porous silicon...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02587G, PaperD. Gallach, A. Munoz-Noval, V. Torres-Costa, M. Manso-SilvanCorrelation between luminescence and fine structure changes...
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Mass partitioning effects in diffusion transport
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02720A, PaperMilos Kojic, Miljan Milosevic, Suhong Wu, Elvin Blanco, Mauro Ferrari, Arturas ZiemysMass partitioning may have a substantial...
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Strength order and nature of the [small pi]-hole bond of cyanuric chloride...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP03076E, PaperHui Wang, Chen Li, Weizhou Wang, Wei Jun JinThe 3ClN/3NX- [small pi]-hole bond is electrostatically attractive in nature. In...
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Structure and optoelectronic properties of helical pyridine-furan,...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02872H, PaperHarikrishna Sahu, Shashwat Gupta, Priyank Gaur, Aditya N. PandaThe optoelectronic properties of helical structures...
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Electron-vibration entanglement in the Born-Oppenheimer description of...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02239H, PaperLaura K. McKemmish, Ross H. McKenzie, Noel S. Hush, Jeffrey R. ReimersEntanglement in the diabatic basis produces useful...
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Theoretical study of the pathway to heterogeneous nucleation of liquid copper...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02215K, PaperXuyan Zhou, Weikang Wu, Yezeng He, Yifan Li, Long Wang, Hui LiThe induced effect from the substrate decays with the...
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Vibrational lifetimes and friction in adsorbate motion determined from...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP03123K, PaperBarbara A. J. Lechner, Holly Hedgeland, Andrew P. Jardine, William Allison, B. J. Hinch, John EllisThe vibrations of an...
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Coherent light-driven electron transport through polycyclic aromatic...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02663F, PaperLiang-Yan Hsu, Herschel RabitzLaser frequency, field intensity, and polarization angle dependence of photon assisted...
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Accurate quantum chemical modelling of the separation of Eu3+ from Am3+/Cm3+...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP03100A, PaperXiaoyan Cao, Jun Zhang, Daniel Weissmann, Michael Dolg, Xuebo ChenThe liquid-liquid extraction of Eu(III) with Cyanex272 from...
View ArticlePredicting Near-UV Electronic Circular Dichroism in Nucleosomal DNA by Means...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP02481A, PaperPatrick Norman, Joseph Parello, Prasad Polavarapu, Mathieu LinaresIt is demonstrated that time-dependent density...
View ArticleInitial Inhomogeneity Induced Crazy-Clock Behavior in the Iodate-Arsenous...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP02572A, PaperLaszlo Valkai, Gyorgy Cseko, Attila HorvathIt is unambiguously demonstrated that in case of an autocatalytic reaction...
View ArticleProbing the Mechanism of CO2 Capture in Diamine-Appended Metal-Organic...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP02951A, PaperWalter S. Drisdell, Roberta Poloni, Thomas M McDonald, Tod A Pascal, Liwen F Wan, Chaitanya D Pemmaraju, Bess...
View ArticleLuminescence and X-ray absorption studies on 0.5 % Ce3+ doped BaCa2MgSi2O8...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP03668B, PaperDejian Hou, Weijie Zhou, Cen Wu, Pieter Dorenbos, Hongbin Liang, Tsun-Kong Sham, Bingbing Zhang, Yan Huang, Ye Tao0.5%...
View ArticleApproaching 100% coverage CH3NH3PbI3-xClx films with highly oriented crystal...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP03934G, PaperLike Huang, Ziyang Hu, Guoqiang Yue, Jinwang Liu, Xiaohong Cui, Jing Zhang, Yuejin ZhuDepositing pinhole-free perovskite...
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Framework structured Na4Mn4Ti5O18 as an electrode for Na-ion storage hybrid...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02866C, PaperM. Jayakumar, K. Hemalatha, K. Ramesha, A. S. PrakashIn this study, framework structured Na4Mn4Ti5O18 possessing S-shaped...
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Nonlinear effects in infrared action spectroscopy of silicon and vanadium...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP02304A, PaperFlorent Calvo, Yejun Li, Denis M. Kiawi, Joost M. Bakker, Pascal Parneix, Ewald JanssensNonlinear effects in infrared action...
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Reversibility and two state behaviour in the thermal unfolding of oligomeric...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP01599E, PaperSergio Romero-Romero, Miguel Costas, Adela Rodriguez-Romero, D. Alejandro Fernandez-VelascoThe reversible thermal unfolding...
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Insights from the computational studies on the oxidized as-isolated state of...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP03071D, PaperSwaminathan Angeline Vedha, Gunasekaran Velmurugan, Rajangam Jagadeesan, Ponnambalam VenuvanalingamA density functional...
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