Editorial Special Issue of Chemical Society Reviews on Current Advances in Crystallography
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DSD-PBEP86: in search of the best double-hybrid DFT with spin-component scaled MP2 and dispersion corrections
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DOI: 10.1039/C1CP22592H
In situ study of electrochemical activation and surface segregation of the SOFC electrode material La0.75Sr0.25Cr0.5Mn0.5O3±δ
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DOI: 10.1039/C1CP21743G
The yin and yang of amyloid: insights from α-synuclein and repeat domain of Pmel17
Ryan P. McGlinchey, Thai Leong Yap, Jennifer C. Lee
DOI: 10.1039/C1CP21376H
Superposition-additive approach: thermodynamic parameters of clusterization of monosubstituted alkanes at the air/water interface
Yu. B. Vysotsky, E. A. Belyaeva, E. S. Fomina, V. B. Fainerman, E. V. Aksenenko, D. Vollhardt, R. Miller
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Aromaticity in heterocyclic analogues of benzene: comprehensive analysis of structural aspects, electron delocalization and magnetic characteristics
Irina V. Omelchenko, Jerzy Leszczynski, Stijn Fias, Patrick Bultinck
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Environmental effects on vibrational properties of carotenoids: experiments and calculations on peridinin
Daniele Bovi, Bertrand Chazallon, Riccardo Spezia
DOI: 10.1039/C1CP21985E
Three-dimensional porous silicon–MWNT heterostructure with superior lithium storage performance
Pengfei Gao, Haiping Jia, Jun Yang, Yanna Nuli, Jiulin Wang, Jun Chen
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A method for creating a non-equilibrium NT(P1 − P2) ensemble in molecular dynamics simulation
Cunkui Huang, Phillip Y. K. Choi, Larry W. Kostiuk
DOI: 10.1039/C1CP21492F
Surface structure of sulfuric acid solution relevant to sulfate aerosol: molecular dynamics simulation combined with sum frequency generation measurement
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Chemical Society Reviews

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