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Physical Chemistry Chemical Physics : PCCP|May 14, 2016
Design of spin-forbidden transitions for polypyridyl metal complexes by time-dependent density functional theory including spin-orbit interactionShohei Kanno, Yutaka Imamura, Masahiko HadaPhysical Chemistry Chemical Physics : PCCP|May 17, 2016
Theoretical investigations of absorption and fluorescence spectra of protonated pyreneChih-Hao Chin, Sheng Hsien LinPhysical Chemistry Chemical Physics : PCCP|May 17, 2016
Significant curvature effects of partially charged carbon nanotubes on electrolyte behavior investigated using Monte Carlo simulationsT OhbaPhysical Chemistry Chemical Physics : PCCP|May 24, 2016
Fabrication of freestanding silk fibroin films containing Ag nanowires/NaYF4:Yb,Er nanocomposites with metal-enhanced fluorescence behaviorBing Zhao, Ning Qi, Ke-Qin Zhang, et al.Physical Chemistry Chemical Physics : PCCP|May 24, 2016
Electrochemical interfacial influences on deoxygenation and hydrogenation reactions in CO reduction on a Cu(100) surfaceTian Sheng, Wen-Feng Lin, Shi-Gang SunPhysical Chemistry Chemical Physics : PCCP|May 24, 2016
"XA6" octahedra influencing the arrangement of anionic groups and optical properties in inverse-perovskite [B6O10]XA3 (X = Cl, Br; A = alkali metal)Zhihua Yang, Bing-Hua Lei, Bin Yang, et al.Physical Chemistry Chemical Physics : PCCP|May 25, 2016
The fragment molecular orbital method combined with density-functional tight-binding and the polarizable continuum modelYoshio Nishimoto, Dmitri G FedorovPhysical Chemistry Chemical Physics : PCCP|May 25, 2016
Theory of reactions at electrified interfacesJessica Lück, Arnulf LatzPhysical Chemistry Chemical Physics : PCCP|May 25, 2016
Correction: Assembly and relaxation behaviours of phosphatidylethanolamine monolayers investigated by polarization and frequency resolved SFG-VSFeng Wei, Wei Xiong, Wenhui Li, et al.Physical Chemistry Chemical Physics : PCCP|May 26, 2016
QM/MM study of l-lactate oxidation by flavocytochrome b2N Gillet, J J Ruiz-Pernía, A de la Lande, et al.Pageof 4,887