Enhanced electron extraction capability of polymer solar cells via modifying the cathode buffer layer with inorganic quantum dots (English)
- New search for: Li, Zhiqi
- New search for: Li, Zhiqi
- New search for: Li, Shujun
- New search for: Zhang, Zhihui
- New search for: Zhang, Xinyuan
- New search for: Li, Jingfeng
- New search for: Liu, Chunyu
- New search for: Shen, Liang
- New search for: Guo, Wenbin
- New search for: Ruan, Shengping
In:
Physical chemistry, chemical physics
;
18
, 16
; 11435-11442
;
2016
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ISSN:
- Article (Journal) / Print
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Title:Enhanced electron extraction capability of polymer solar cells via modifying the cathode buffer layer with inorganic quantum dots
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Contributors:Li, Zhiqi ( author ) / Li, Shujun / Zhang, Zhihui / Zhang, Xinyuan / Li, Jingfeng / Liu, Chunyu / Shen, Liang / Guo, Wenbin / Ruan, Shengping
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Published in:Physical chemistry, chemical physics ; 18, 16 ; 11435-11442
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Publisher:
- New search for: The Royal Soc. of Chemistry
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Place of publication:Cambridge
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Publication date:2016
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ISSN:
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ZDBID:
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DOI:
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 35.10
- Further information on Basic classification
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Keywords:
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Source:
Table of contents – Volume 18, Issue 16
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 11000
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Direct calculation of the X-ray structure factor of ionic liquidsLiu, Hongjun / Paddison, Stephen J. et al. | 2016
- 17
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Adjusting the thermoelectric properties of copper(i) oxide-graphite-polymer pastes and the applications of such flexible compositesElectronic supplementary information (ESI) available: Experimental procedures, statistic interpretation of the measurements, further comments and device manufacturing steps. See DOI: 10.1039/c5cp06828bAndrei, Virgil et al. | 2016
- 18
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Charge carrier dynamics of methylammonium lead iodide: from PbI2-rich to low-dimensional broadly emitting perovskitesElectronic supplementary information (ESI) available: Changes of XRD patterns for x = 0.71 upon annealing; optimized annealing condition monitored by XRD; transient Vis-NIR spectra at the pump fluence 14 μJ cm−2; analysis of recombination kinetics. See DOI: 10.1039/c5cp07167dKlein, Johannes R et al. | 2016
- 118
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Adsorption of PTCDA and C60 on KBr(001): electrostatic interaction versus electronic hybridizationElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07999cJia, Qian et al. | 2016
- 10680
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Editorial of the PCCP themed issue on “Basic Mechanisms in Energy Conversion”Ludwig, Ralf / Wagner, Joachim / Beller, Matthia / Brückner, Angelika / Kragl, Udo / Kühn, Oliver et al. | 2016
- 178
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CoOx thin film deposited by CVD as efficient water oxidation catalyst: change of oxidation state in XPS and its correlation to electrochemical activityElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp05691hWeidler, Natascha et al. | 2016
- 10840
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How many bound valence states does the C60− anion have?Gromov, Evgeniy V. / Klaiman, Shachar / Cederbaum, Lorenz S. et al. | 2016
- 10850
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The structure–function relationship for alumina supported platinum during the formation of ammonia from nitrogen oxide and hydrogen in the presence of oxygenAdams, Emma Catherine / Merte, Lindsay Richard / Hellman, Ander / Skoglundh, Magnu / Gustafson, Johan / Bendixen, Eva Charlotte / Gabrielsson, Pär / Bertram, Florian / Evertsson, Jona / Zhang, Chu et al. | 2016
- 189
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Identification and exclusion of intermediates of photocatalytic CO2 reduction on TiO2 under conditions of highest purityElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07148hPougin, Anna et al. | 2016
- 196
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A systematic study on Pt based, subnanometer-sized alloy cluster catalysts for alkane dehydrogenation: effects of intermetallic interactionElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp00360eHauser, Andreas W et al. | 2016
- 1112
-
Designing graphene as a new frustrated Lewis pair catalyst for hydrogen activation by co-dopingElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07969aSun, XiaoYing et al. | 2016
- 1115
-
Effects of CO and CO2 on the desulfurization of H2S using a ZnO sorbent: a density functional theory studyElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp01422dLing, Lixia et al. | 2016
- 1117
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Heteronuclear DNP of protons and deuterons with TEMPOLElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06689aKaminker, I et al. | 2016
- 1122
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Reconstruction and dissolution of shape-controlled Pt nanoparticles in acidic electrolytesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07832fDevivaraprasad, Ruttala et al. | 2016
- 1122
-
Isodesmic reaction for accurate theoretical pKa calculations of amino acids and peptidesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07053hSastre, S et al. | 2016
- 1133
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Geometric and electronic structures of the synthetic Mn4CaO4 model compound mimicking the photosynthetic oxygen-evolving complexElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07226cShoji, Mitsuo et al. | 2016
- 1136
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Conformation-specific spectroscopy of capped glutamine-containing peptides: role of a single glutamine residue on peptide backbone preferencesElectronic supplementary information (ESI) available: Detailed information regarding the synthetic procedures for Ac-Gln-NHBn and Ac-Ala-Gln-NHBn, potential energy scan of the carboxylic acid OH rotation, additional calculated non-assigned structures of Z-Gln-OH, Z-Gln-NHMe, Ac-Gln-NHBn, and Ac-Ala-Gln-NHBn, comparison of NHBn versus NHMe structure of double bridge structure calculated for Ala-Gln, a comparison between Ac-Gln-NHBn conformer B and Ac-Ala-Gln-NHBn conformer A, a table summarizing the experimental and calculated vibrational frequencies, and a table summarizing the energies of Ac-Gln-X and Ac-Ala-Gln-X molecules (X = -NHBn and -NHMe). See DOI: 10.1039/c6cp01062hWalsh, Patrick S et al. | 2016
- 1141
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Extreme population inversion in the fragments formed by UV photoinduced S-H bond fission in 2-thiophenethiolElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp01593jIngle, Rebecca A et al. | 2016
- 11042
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Glass polymorphism in glycerol–water mixtures: I. A computer simulation studyJahn, David A. / Wong, Jessina / Bachler, Johanne / Loerting, Thoma / Giovambattista, Nicola et al. | 2016
- 1146
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CdSe-sensitized branched CdS hierarchical nanostructures for efficient photoelectrochemical solar hydrogen generationElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp00692bHan, Zonghu et al. | 2016
- 1148
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Homonuclear decoupling for spectral simplification of carbon-13 enriched molecules in solution-state NMR enhanced by dissolution DNPElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07884aChinthalapalli, Srinivas et al. | 2016
- 11520
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Monte-Carlo modelling of nano-material photocatalysis: bridging photocatalytic activity and microscopic charge kineticsLiu, Baoshun et al. | 2016
- 11503
-
Thermal optical non-linearity of nematic mesophase enhanced by gold nanoparticles – an experimental and numerical investigationKurochkin, O. / Murugesan, Y. K. / Bennett, T. P. / D'Alessandro, G. / Reznikov, Y. / Tang, B. J. / Mehl, G. H. / Kaczmarek, M. et al. | 2016
- 11550
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Electric field control of the magnetic anisotropy energy of double-vacancy graphene decorated by iridium atomsGe, Gui-Xian / Li, Ying-Bin / Wang, Guang-Hou / Wan, Jian-Guo et al. | 2016
- 11560
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Back cover| 2016
- 11058
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Glass polymorphism in glycerol–water mixtures: II. Experimental studiesBachler, Johanne / Fuentes-Landete, Violeta / Jahn, David A. / Wong, Jessina / Giovambattista, Nicola / Loerting, Thoma et al. | 2016
- 1169
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The plausible role of carbonate in photo-catalytic water oxidation processesElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07389hKornweitz, Haya et al. | 2016
- 10651
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Front cover| 2016
- 10652
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Inside front cover| 2016
- 10653
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Contents list| 2016
- 1682
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Ultrafast excited state dynamics of iridium(iii) complexes and their changes upon immobilisation onto titanium dioxide layersElectronic supplementary information (ESI) available: Experimental and synthetic details. UV/vis-, Raman- and time-resolved emission measurements. Transient absorption spectra of 1, 2 and 2T. See DOI: 10.1039/c6cp00343eTschierlei, Stefanie et al. | 2016
- 1688
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In search of metal hydrides: an X-ray absorption and emission study of [NiFe] hydrogenase model complexesElectronic supplementary information (ESI) available: xyz coordinates of calculated structures. See DOI: 10.1039/c5cp07293jHugenbruch, Stefan et al. | 2016
- 10719
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Improved charge carrier separation in barium tantalate composites investigated by laser flash photolysisSchneider, Jenny / Nikitin, Konstantin / Wark, Michael / Bahnemann, Detlef W. / Marschall, Roland et al. | 2016
- 1727
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A comprehensive comparison of dye-sensitized NiO photocathodes for solar energy conversionElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp05326aWood, Christopher J et al. | 2016
- 1751
-
Band engineering for efficient catalyst-substrate coupling for photoelectrochemical water splittingElectronic supplementary information (ESI) available: Current-voltage characteristic of a tandem cell under AM1.5 as well as XRD of the TiO2 layer and SEM of TiO2 thin films modified with platinum catalyst. See DOI: 10.1039/c5cp06230fKlett, Joachim et al. | 2016
- 10758
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Electrochemically induced sol–gel deposition of ZnO films on Pt-nanoparticle modified FTO surfaces for enhanced photoelectrocatalytic energy conversionGutkowski, Ramona / Schuhmann, Wolfgang et al. | 2016
- 1764
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Calorimetric and spectroscopic studies on solvation energetics for H2 storage in the CO2/HCOOH systemElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06996cFink, Cornel et al. | 2016
- 1781
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Methanol synthesis via CO2 hydrogenation over a Au/ZnO catalyst: an isotope labelling study on the role of CO in the reaction processElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp06888fHartadi, Yeusy et al. | 2016
- 1792
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Elucidation of adsorption processes at the surface of Pt(331) model electrocatalysts in acidic aqueous mediaElectronic supplementary information (ESI) available: Further experimental details and supporting experimental data. See DOI: 10.1039/c5cp08000bPohl, Marcus D et al. | 2016
- 1818
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Photon upconversion: from two-photon absorption (TPA) to triplet-triplet annihilation (TTA)Ye, Changqing et al. | 2016
- 1836
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Large-size nanosheets of 9,10-bis(phenylethynyl)anthracene with high photoresponse and light emission anisotropyElectronic supplementary information (ESI) available: Experimental section, single crystal structure, FTIR and UV-Vis spectra, and transfer characteristics. See DOI: 10.1039/c5cp05507eWang, Juan-Ye et al. | 2016
- 1846
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Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteriesElectronic supplementary information (ESI) available: Experimental and computational details and additional tables and plots. CCDC 1452270. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c6cp01157hMalliakas, Christos D et al. | 2016
- 1856
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Heterocarbon nanosheets incorporating iron phthalocyanine for oxygen reduction reaction in both alkaline and acidic mediaElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07739gHyun, Koangyong et al. | 2016
- 1864
-
Selective adsorption of arsenate and the reversible structure transformation of the mesoporous metal-organic framework MIL-100(Fe)Electronic supplementary information (ESI) available. See DOI: 10.1039/c6cp00249hCai, Jianhua et al. | 2016
- 1868
-
Bistable N-H N hydrogen bonds for reversibly modulating the dynamic motion in an organic co-crystalElectronic supplementary information (ESI) available: The experimental details, crystallographical data (CIF), and additional data. CCDC 1434221 and 1434222 for 1. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c6cp01073cJi, Chengmin et al. | 2016
- 10873
-
Effect of the alkaline cation size on the conductivity in gel polymer electrolytes and their influence on photo electrochemical solar cellsBandara, T. M. W. J. / Fernando, H. D. N. S. / Furlani, M. / Albinsson, I. / Dissanayake, M. A. K. L. / Ratnasekera, J. L. / Mellander, B.-E. et al. | 2016
- 1882
-
Thickness-dependent photocatalytic performance of graphite oxide for degrading organic pollutants under visible lightElectronic supplementary information (ESI) available: UV-vis absorption, XPS, FT-IR spectra of GO samples, TEM images of graphene oxide, and DFT calculations. See DOI: 10.1039/c6cp00582aOh, Junghoon et al. | 2016
- 10887
-
A medium range order structural connection to the configurational heat capacity of borate–silicate mixed glassesLiu, Hao / Smedskjaer, Morten M. / Tao, Haizheng / Jensen, Lars R. / Zhao, Xiujian / Yue, Yuanzheng et al. | 2016
- 1918
-
In situ electrodeposition of a Cu2O/SnO2 periodical heterostructure film for photosensor applicationsElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp00772dCui, Guangliang et al. | 2016
- 10941
-
Dynamics and spectroscopy of CH2OO excited electronic statesKalinowski, Jaroslaw / Foreman, Elizabeth S. / Kapnas, Kara M. / Murray, Craig / Räsänen, Markku / Benny Gerber, R. et al. | 2016
- 1947
-
An intensive dispersion and synchronous assembly of single-walled carbon nanotubes in a surfactant-oil-water association systemElectronic supplementary information (ESI) available: The details of DPD simulations and additional spectroscopic data. See DOI: 10.1039/c6cp00397dZhang, Yan et al. | 2016
- 1954
-
Effects of inter- and intra-aggregate magnetic dipolar interactions on the magnetic heating efficiency of iron oxide nanoparticlesElectronic supplementary information (ESI) available: Additional experimental data and information about numerical simulations. See DOI: 10.1039/c6cp00468gOvejero, J. G et al. | 2016
- 1964
-
An artificial photosynthetic model based on a molecular triad of boron dipyrromethene and phthalocyanineElectronic supplementary information (ESI) available: Additional UV-Vis and transient absorption spectra. See DOI: 10.1039/c6cp00920dErmilov, Eugeny A et al. | 2016
- 1976
-
Thermal stability of photoluminescence in Cu-doped Zn-In-S quantum dots for light-emitting diodesElectronic supplementary information (ESI) available: The temperature-dependent PL spectra and decay curves of green and red Cu:Zn-In-S core QDs and Cu:Zn-In-S/ZnS core/shell QDs. See DOI: 10.1039/c6cp00240dYuan, Xi et al. | 2016
- 1983
-
Fourth stable radical species in X-irradiated solid-state sucroseElectronic supplementary information (ESI) available: Angular dependence of the Q-band EIE spectra of the fourth radical species, Schonland conjugates of the experimental tensors and comparison of the experimental HF tensors to the calculated ones. See DOI: 10.1039/c6cp01118gKusakovskij, Jevgenij et al. | 2016
- 10992
-
The role of the confined water in the dynamic crossover of hydrated lysozyme powdersKurzweil-Segev, Y. / Greenbaum (Gutina), A. / Popov, I. / Golodnitsky, D. / Feldman, Yu. et al. | 2016
- 10682
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Ultrafast excited state dynamics of iridium(iii) complexes and their changes upon immobilisation onto titanium dioxide layersTschierlei, Stefanie / Neubauer, Antje / Rockstroh, Nil / Karnahl, Michael / Schwarzbach, Patrick / Junge, Henrik / Beller, Matthia / Lochbrunner, Stefan et al. | 2016
- 10688
-
In search of metal hydrides: an X-ray absorption and emission study of [NiFe] hydrogenase model complexesHugenbruch, Stefan / Shafaat, Hannah S. / Krämer, Tobia / Delgado-Jaime, Mario Ulise / Weber, Katharina / Neese, Frank / Lubitz, Wolfgang / DeBeer, Serena et al. | 2016
- 10700
-
Adjusting the thermoelectric properties of copper(i) oxide–graphite–polymer pastes and the applications of such flexible compositesAndrei, Virgil / Bethke, Kevin / Rademann, Klau et al. | 2016
- 10708
-
CoOx thin film deposited by CVD as efficient water oxidation catalyst: change of oxidation state in XPS and its correlation to electrochemical activityWeidler, Natascha / Paulus, Sarina / Schuch, Jona / Klett, Joachim / Hoch, Sascha / Stenner, Patrick / Maljusch, Artjom / Brötz, Joachim / Wittich, Carolin / Kaiser, Bernhard et al. | 2016
- 10727
-
A comprehensive comparison of dye-sensitized NiO photocathodes for solar energy conversionWood, Christopher J. / Summers, Gareth H. / Clark, Charlotte A. / Kaeffer, Nicola / Braeutigam, Maximilian / Carbone, Lea Roberta / D'Amario, Luca / Fan, Ke / Farré, Yoann / Narbey, Stéphanie et al. | 2016
- 10739
-
Redox potential tuning by redox-inactive cations in nature's water oxidizing catalyst and synthetic analoguesKrewald, Vera / Neese, Frank / Pantazis, Dimitrios A. et al. | 2016
- 10751
-
Band engineering for efficient catalyst-substrate coupling for photoelectrochemical water splittingKlett, Joachim / Ziegler, Jürgen / Radetinac, Aldin / Kaiser, Bernhard / Schäfer, Rolf / Jaegermann, Wolfram / Urbain, Félix / Becker, Jan-Philipp / Smirnov, Vladimir / Finger, Friedhelm et al. | 2016
- 10764
-
Calorimetric and spectroscopic studies on solvation energetics for H2 storage in the CO2/HCOOH systemFink, Cornel / Katsyuba, Sergey / Laurenczy, Gabor et al. | 2016
- 10774
-
Reactive oxygen species formed in organic lithium–oxygen batteriesSchwager, Patrick / Dongmo, Saustin / Fenske, Daniela / Wittstock, Gunther et al. | 2016
- 10781
-
Methanol synthesis via CO2 hydrogenation over a Au/ZnO catalyst: an isotope labelling study on the role of CO in the reaction processHartadi, Yeusy / Widmann, Daniel / Behm, R. Jürgen et al. | 2016
- 10792
-
Elucidation of adsorption processes at the surface of Pt(331) model electrocatalysts in acidic aqueous mediaPohl, Marcus D. / Colic, Viktor / Scieszka, Daniel / Bandarenka, Aliaksandr S. et al. | 2016
- 10800
-
Charge carrier dynamics of methylammonium lead iodide: from PbI2-rich to low-dimensional broadly emitting perovskitesKlein, Johannes R. / Flender, Oliver / Scholz, Mirko / Oum, Kawon / Lenzer, Thoma et al. | 2016
- 10809
-
Identification and exclusion of intermediates of photocatalytic CO2 reduction on TiO2 under conditions of highest purityPougin, Anna / Dilla, Martin / Strunk, Jennifer et al. | 2016
- 10836
-
Large-size nanosheets of 9,10-bis(phenylethynyl)anthracene with high photoresponse and light emission anisotropyWang, Juan-Ye / Peng, Hong-Dan / Yang, Jia-Mei / Yan, Jing-Hui / Pan, Ge-Bo et al. | 2016
- 10846
-
Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteriesMalliakas, Christos D. / Leung, Kevin / Pupek, Krzysztof Z. / Shkrob, Ilya A. / Abraham, Daniel P. et al. | 2016
- 10856
-
Heterocarbon nanosheets incorporating iron phthalocyanine for oxygen reduction reaction in both alkaline and acidic mediaHyun, Koangyong / Ueno, Tomonaga / Panomsuwan, Gasidit / Li, Oi Lun / Saito, Nagahiro et al. | 2016
- 10864
-
Selective adsorption of arsenate and the reversible structure transformation of the mesoporous metal–organic framework MIL-100(Fe)Cai, Jianhua / Wang, Xueyun / Zhou, Yue / Jiang, Li / Wang, Chunru et al. | 2016
- 10868
-
Bistable N–H⋯N hydrogen bonds for reversibly modulating the dynamic motion in an organic co-crystalJi, Chengmin / Li, Shenhui / Deng, Feng / Liu, Sijie / Asghar, Muhammad Adnan / Sun, Zhihua / Hong, Maochun / Luo, Junhua et al. | 2016
- 10882
-
Thickness-dependent photocatalytic performance of graphite oxide for degrading organic pollutants under visible lightOh, Junghoon / Chang, Yun Hee / Kim, Yong-Hyun / Park, Sungjin et al. | 2016
- 10896
-
The crystallization of metal soaps and fatty acids in oil paint model systemsHermans, Joen J. / Keune, Katrien / Loon, Annelies van / Iedema, Piet D. et al. | 2016
- 10906
-
A systematic study on Pt based, subnanometer-sized alloy cluster catalysts for alkane dehydrogenation: effects of intermetallic interactionHauser, Andreas W. / Horn, Paul R. / Head-Gordon, Martin / Bell, Alexis T. et al. | 2016
- 10918
-
In situ electrodeposition of a Cu2O/SnO2 periodical heterostructure film for photosensor applicationsCui, Guangliang / Xiao, Chuanhai / Zhang, Pinhua / Zhang, Mingzhe et al. | 2016
- 10924
-
Structure and reorientational dynamics of 1-F-adamantaneBen Hassine, B. / Negrier, Ph. / Romanini, M. / Barrio, M. / Macovez, R. / Kallel, A. / Mondieig, D. / Tamarit, J. Ll. et al. | 2016
- 10931
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Early stages of catalyst aging in the iridium mediated water oxidation reactionHetterscheid, Dennis G. H. / van der Ham, Cornelis J. M. / Diaz-Morales, Oscar / Verhoeven, M. W. G. M. (Tiny) / Longo, Alessandro / Banerjee, Dipanjan / Niemantsverdriet, J. W. (Hans) / Reek, Joost N. H. / Feiters, Martin C. et al. | 2016
- 10947
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An intensive dispersion and synchronous assembly of single-walled carbon nanotubes in a surfactant–oil–water association systemZhang, Yan / Li, Dechun / Wu, Lin / Zhou, Liang / Du, Yanan / Wang, Meng / Li, Ying et al. | 2016
- 10954
-
Effects of inter- and intra-aggregate magnetic dipolar interactions on the magnetic heating efficiency of iron oxide nanoparticlesOvejero, J. G. / Cabrera, D. / Carrey, J. / Valdivielso, T. / Salas, G. / Teran, F. J. et al. | 2016
- 10964
-
An artificial photosynthetic model based on a molecular triad of boron dipyrromethene and phthalocyanineErmilov, Eugeny A. / Liu, Jian-Yong / Menting, Roel / Huang, Ying-Si / Röder, Beate / Ng, Dennis K. P. et al. | 2016
- 10976
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Thermal stability of photoluminescence in Cu-doped Zn–In–S quantum dots for light-emitting diodesYuan, Xi / Ma, Ruixin / Hua, Jie / Liu, Yang / Li, Ji / Zhang, Wenjin / Zhao, Jialong / Li, Haibo et al. | 2016
- 10983
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Fourth stable radical species in X-irradiated solid-state sucroseKusakovskij, Jevgenij / Caretti, Ignacio / Van Doorslaer, Sabine / Callens, Freddy / Vrielinck, Henk et al. | 2016
- 11008
-
Adsorption of PTCDA and C60 on KBr(001): electrostatic interaction versus electronic hybridizationJia, Qian / Hu, Zhi-Xin / Ji, Wei / Burke, Sarah A. / Gao, Hong-Jun / Grütter, Peter / Guo, Hong et al. | 2016
- 11017
-
Heteronuclear DNP of protons and deuterons with TEMPOLKaminker, I. / Shimon, D. / Hovav, Y. / Feintuch, A. / Vega, S. et al. | 2016
- 11069
-
The plausible role of carbonate in photo-catalytic water oxidation processesKornweitz, Haya / Meyerstein, Dan et al. | 2016
- 11073
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Isolation of pristine MXene from Nb4AlC3 MAX phase: a first-principles studyMishra, Avanish / Srivastava, Pooja / Mizuseki, Hiroshi / Lee, Kwang-Ryeol / Singh, Abhishek K. et al. | 2016
- 11081
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Switching between cis and trans anions of 2-(2′-hydroxyphenyl)benzimidazole: a molecular rotation perturbed by chemical stabilizationSahu, Saugata / Das, Minati / Krishnamoorthy, G. et al. | 2016
- 11081
-
Switching between cis and trans anions of 2-(2prime-hydroxyphenyl)benzimidazole: a molecular rotation perturbed by chemical stabilizationSahu, S. / Das, M. / Krishnamoorthy, G. et al. | 2016
- 11091
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Near-UV photodissociation dynamics of CH2I2Toulson, Benjamin W. / Alaniz, Jonathan P. / Grant Hill, J. / Murray, Craig et al. | 2016
- 11104
-
Mildly reduced less defective graphene oxide/sulfur/carbon nanotube composite films for high-performance lithium–sulfur batteriesLi, Rui / Zhang, Miao / Li, Yingru / Chen, Ji / Yao, Bowen / Yu, Mingpeng / Shi, Gaoquan et al. | 2016
- 11111
-
Exploring the mechanism of water-splitting reaction in NiOx/β-Ga2O3 photocatalysts by first-principles calculationsZhou, Xin / Dong, Hao / Ren, Ai-Min et al. | 2016
- 11111
-
Exploring the mechanism of water-splitting reaction in NiOx/b-Ga2O3 photocatalysts by first-principles calculationsZhou, X. / Dong, H. / Ren, A. M. et al. | 2016
- 11120
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Designing graphene as a new frustrated Lewis pair catalyst for hydrogen activation by co-dopingSun, XiaoYing / Li, Bo / Liu, TianFu / Song, Jian / Su, Dang Sheng et al. | 2016
- 11125
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Effects of Pt dispersion on electronic and oxide ionic conductivity in Pr1.90Ni0.71Cu0.24Ga0.05O4Ishihara, T. / Hyodo, J. / Schraknepper, H. / Tominaga, K. / Ida, S. et al. | 2016
- 11132
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Photo-degradation in air of the active layer components in a thiophene–quinoxaline copolymer:fullerene solar cellHansson, Rickard / Lindqvist, Camilla / Ericsson, Leif K. E. / Opitz, Andrea / Wang, Ergang / Moons, Ellen et al. | 2016
- 11139
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Ni on the CeO2(110) and (100) surfaces: adsorption vs. substitution effects on the electronic and geometric structures and oxygen vacanciesLi, W. Q. / Goverapet Srinivasan, S. / Salahub, D. R. / Heine, T. et al. | 2016
- 11150
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Effects of CO and CO2 on the desulfurization of H2S using a ZnO sorbent: a density functional theory studyLing, Lixia / Zhao, Zhongbei / Wang, Baojun / Fan, Maohong / Zhang, Riguang et al. | 2016
- 11157
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One-step in situ synthesis of CeO2 nanoparticles grown on reduced graphene oxide as an excellent fluorescent and photocatalyst material under sunlight irradiationKumar, Sachin / Ojha, Animesh K. / Patrice, Donfack / Yadav, Brajesh S. / Materny, Arnulf et al. | 2016
- 11168
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Nucleophilic substitution by amide nitrogen in the aromatic rings of [zn − H]&z.rad;+ ions; the structures of the [b2 − H − 17]&z.rad;+ and [c1 − 17]+ ionsMu, Xiaoyan / Lau, Justin Kai-Chi / Lai, Cheuk-Kuen / Siu, K. W. Michael / Hopkinson, Alan C. / Chu, Ivan K. et al. | 2016
- 11176
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Force exerted by a nanoscale capillary water bridge between two planar substratesValenzuela, Gerson E. / Saavedra, Jorge H. / Rozas, Roberto E. / Toledo, Pedro G. et al. | 2016
- 11184
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Facilitated diffusion in the presence of obstacles on the DNAGomez, David / Klumpp, Stefan et al. | 2016
- 11193
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A neutron scattering and modelling study of aqueous solutions of tetramethylammonium and tetrapropylammonium bromideNilsson, Emelie J. / Alfredsson, Viveka / Bowron, Daniel T. / Edler, Karen J. et al. | 2016
- 11202
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Isodesmic reaction for accurate theoretical pKa calculations of amino acids and peptidesSastre, S. / Casasnovas, R. / Muñoz, F. / Frau, J. et al. | 2016
- 11213
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Effect of electron-donor ancillary ligands on the heteroleptic ruthenium complexes: synthesis, characterization, and application in high-performance dye-sensitized solar cellsChen, Wang-Chao / Kong, Fan-Tai / Liu, Xue-Peng / Guo, Fu-Ling / Zhou, Li / Ding, Yong / Li, Zhao-Qian / Dai, Song-Yuan et al. | 2016
- 11220
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Reconstruction and dissolution of shape-controlled Pt nanoparticles in acidic electrolytesDevivaraprasad, Ruttala / Kar, Tathagata / Chakraborty, Arup / Singh, Ramesh Kumar / Neergat, Manoj et al. | 2016
- 11233
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A theoretical study of nitric oxide adsorption and dissociation on copper-exchanged zeolites SSZ-13 and SAPO-34: the impact of framework acid–base propertiesUzunova, Ellie L. / Mikosch, Han et al. | 2016
- 11243
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Effect of environment on iodine oxidation state and reactivity with aluminumSmith, Dylan K. / McCollum, Jena / Pantoya, Michelle L. et al. | 2016
- 11251
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Effect of cation structure on the oxygen solubility and diffusivity in a range of bis{(trifluoromethyl)sulfonyl}imide anion based ionic liquids for lithium–air battery electrolytesNeale, Alex R. / Li, Peilin / Jacquemin, Johan / Goodrich, Peter / Ball, Sarah C. / Compton, Richard G. / Hardacre, Christopher et al. | 2016
- 11263
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A proposed new scheme for vibronically resolved time-dependent photoelectron spectroscopy: pump–repump-continuous wave-photoelectron spectroscopy (prp-cw-pes)Goel, Prateek / Nooijen, Marcel et al. | 2016
- 11278
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Novel nanorose-like Ce(iii)-doped and undoped Cu(ii)–biphenyl-4,4-dicarboxylic acid (Cu(ii)–BPDCA) MOSs as visible light photocatalysts: synthesis, characterization, photodegradation of toxic dyes and optimizationMousavinia, S. E. / Hajati, S. / Ghaedi, M. / Dashtian, K. et al. | 2016
- 11288
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Photoprotection and triplet energy transfer in higher plants: the role of electronic and nuclear fluctuationsCupellini, Lorenzo / Jurinovich, Sandro / Prandi, Ingrid G. / Caprasecca, Stefano / Mennucci, Benedetta et al. | 2016
- 11297
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A density functional theory study of arsenic immobilization by the Al(iii)-modified zeolite clinoptiloliteAwuah, Joel B. / Dzade, Nelson Y. / Tia, Richard / Adei, Evan / Kwakye-Awuah, Bright / Richard A. Catlow, C. / de Leeuw, Nora H. et al. | 2016
- 11306
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Conformation-specific spectroscopy of capped glutamine-containing peptides: role of a single glutamine residue on peptide backbone preferencesWalsh, Patrick S. / Dean, Jacob C. / McBurney, Carl / Kang, Hyuk / Gellman, Samuel H. / Zwier, Timothy S. et al. | 2016
- 11323
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The role of the internal molecular free volume in defining organic porous copolymer properties: tunable porosity and highly selective CO2 adsorptionZhang, Yindong / Zhu, Yunlong / Guo, Jun / Gu, Shuai / Wang, Yuanyuan / Fu, Yu / Chen, Dongyang / Lin, Yijun / Yu, Guipeng / Pan, Chunyue et al. | 2016
- 11330
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Geometric and electronic structures of the synthetic Mn4CaO4 model compound mimicking the photosynthetic oxygen-evolving complexShoji, Mitsuo / Isobe, Hiroshi / Shen, Jian-Ren / Yamaguchi, Kizashi et al. | 2016
- 11341
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Nonvolatile memory devices based on poly(vinyl alcohol) + graphene oxide hybrid compositesSun, Yanmei / Lu, Junguo / Ai, Chunpeng / Wen, Dianzhong et al. | 2016
- 11348
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Influence of the protonation of pyridine nitrogen on pnicogen bonding: competition and cooperativityWei, Yuanxin / Li, Qingzhong / Li, Wenzuo / Cheng, Jianbo / McDowell, Sean A. C. et al. | 2016
- 11357
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Origins of entropy change for the amphiphilic molecule in micellization: a molecular dynamics studyLiu, Guokui / Wei, Yaoyao / Gao, Fengfeng / Yuan, Shiling / Liu, Chengbu et al. | 2016
- 11362
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Orbital-optimized linearized coupled-cluster doubles with density-fitting and Cholesky decomposition approximations: an efficient implementationBozkaya, Uğur et al. | 2016
- 11374
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Proton coupled electron transfer from the excited state of a ruthenium(ii) pyridylimidazole complexPannwitz, Andrea / Wenger, Oliver S. et al. | 2016
- 11383
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Isothermal microcalorimetry as a tool to study solid–electrolyte interphase formation in lithium-ion cellsHall, David S. / Glazier, Stephen L. / Dahn, J. R. et al. | 2016
- 11391
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Quantum and quasi-classical calculations for the S+ + H2(v,j) → SH+(v′,j′) + H reactive collisionsZanchet, Alexandre / Roncero, Octavio / Bulut, Niyazi et al. | 2016
- 11391
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Quantum and quasi-classical calculations for the S+ + H2(v,j) SH+(vprime,jprime) + H reactive collisionsZanchet, A. / Roncero, O. / Bulut, N. et al. | 2016
- 11401
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Extreme population inversion in the fragments formed by UV photoinduced S–H bond fission in 2-thiophenethiolIngle, Rebecca A. / Karsili, Tolga N. V. / Dennis, Gregg J. / Staniforth, Michael / Stavros, Vasilios G. / Ashfold, Michael N. R. et al. | 2016
- 11411
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Underlying mechanisms of the synergistic role of Li2MnO3 and LiNi1/3Co1/3Mn1/3O2 in high-Mn, Li-rich oxidesLim, Jin-Myoung / Kim, Duho / Park, Min-Sik / Cho, Maenghyo / Cho, Kyeongjae et al. | 2016
- 11422
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Theoretical predictions of structures in dispersions containing charged colloidal particles and non-adsorbing polymersXie, Fei / Turesson, Martin / Woodward, Clifford E. / van Gruijthuijsen, Kitty / Stradner, Anna / Forsman, Jan et al. | 2016
- 11435
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Enhanced electron extraction capability of polymer solar cells via modifying the cathode buffer layer with inorganic quantum dotsLi, Zhiqi / Li, Shujun / Zhang, Zhihui / Zhang, Xinyuan / Li, Jingfeng / Liu, Chunyu / Shen, Liang / Guo, Wenbin / Ruan, Shengping et al. | 2016
- 11443
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Vibronic coupling in the excited-states of carotenoidsMiki, Takeshi / Buckup, Tiago / Krause, Marie S. / Southall, June / Cogdell, Richard J. / Motzkus, Marcu et al. | 2016
- 11443
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Vibronic coupling in the excited-states of carotenoidsElectronic supplementary information (ESI) available: Information on (1) the 1800 cm−1 mode of neurosporene, (2) the absorption spectrum of lutein in different solvents and (3) the accuracy of the time constants for the sequential model. See DOI: 10.1039/c5cp07542dMiki, Takeshi et al. | 2016
- 11454
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Femtosecond to nanosecond excited state dynamics of vapor deposited copper phthalocyanine thin filmsCaplins, Benjamin W. / Mullenbach, Tyler K. / Holmes, Russell J. / Blank, David A. et al. | 2016
- 11460
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CdSe-sensitized branched CdS hierarchical nanostructures for efficient photoelectrochemical solar hydrogen generationHan, Zonghu / Wang, Meng / Chen, Xiangyan / Shen, Shaohua et al. | 2016
- 11467
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Structural analysis of bioinspired nano materials with synchrotron far IR spectroscopySeoudi, Rania S. / Dowd, Annette / Smith, Brian J. / Mechler, Adam et al. | 2016
- 11474
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Giant strain geared to transformable H-bonded network in compressed β-d-mannosePatyk, Ewa / Jenczak, Anna / Katrusiak, Andrzej et al. | 2016
- 11474
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Giant strain geared to transformable H-bonded network in compressed b-D-mannosePatyk, E. / Jenczak, A. / Katrusiak, A. et al. | 2016
- 11480
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Homonuclear decoupling for spectral simplification of carbon-13 enriched molecules in solution-state NMR enhanced by dissolution DNPChinthalapalli, Sriniva / Bornet, Aurélien / Carnevale, Diego / Jannin, Sami / Bodenhausen, Geoffrey et al. | 2016
- 11488
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Insights into the reaction mechanism of 3-O-sulfotransferase through QM/MM calculationsSousa, Rui P. / Fernandes, Pedro A. / Ramos, Maria J. / Brás, Natércia F. et al. | 2016
- 11497
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A new insight into the nanostructure of alkylammonium alkanoates based ionic liquids in waterSalma, Umme / Ballirano, Paolo / Usula, Marianna / Caminiti, Ruggero / Plechkova, Natalia V. / Seddon, Kenneth R. / Gontrani, Lorenzo et al. | 2016
- 11513
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The electronic transport properties of zigzag silicene nanoribbon slices with edge hydrogenation and oxidationZou, Dongqing / Zhao, Wenkai / Fang, Changfeng / Cui, Bin / Liu, Desheng et al. | 2016
- 11528
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Ab initio molecular dynamics determination of competitive O2vs. N2 adsorption at open metal sites of M2(dobdc)Parkes, Marie V. / Greathouse, Jeffery A. / Hart, David B. / Sava Gallis, Dorina F. / Nenoff, Tina M. et al. | 2016
- 11539
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Methane activation by metal-free Lewis acid centers only – a computational design and mechanism studyMa, Gongli / Li, Zhen Hua et al. | 2016
- 11556
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Correction: Large-size nanosheets of 9,10-bis(phenylethynyl)anthracene with high photoresponse and light emission anisotropyWang, Juan-Ye / Peng, Hong-Dan / Yang, Jia-Mei / Yan, Jing-Hui / Pan, Ge-Bo et al. | 2016
- 11558
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Correction: Aromatic cages B420/+: unprecedented existence of octagonal holes in boron clustersTai, Truong Ba / Lee, Sang Uck / Nguyen, Minh Tho et al. | 2016
- 11559
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Inside back cover| 2016
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Switching between cis and trans anions of 2-(2′-hydroxyphenyl)benzimidazole: a molecular rotation perturbed by chemical stabilizationDedicated to Prof. S. K. Dogra on his 74th birthday.Electronic supplementary information (ESI) is available. See DOI: 10.1039/c5cp07949gSahu, Saugata et al. | 2016
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The crystallization of metal soaps and fatty acids in oil paint model systemsElectronic supplementary information (ESI) available: Details of DSC programs; heating rate dependence of melting/crystallization temperature hysteresis; illustrations of the crystalline structures of HPa, PbPa and ZnPa; temperature-dependent ATR-FTIR spectra of PbPa and ZnPa. See DOI: 10.1039/c6cp00487cHermans, Joen J et al. | 2016
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Structure and reorientational dynamics of 1-F-adamantaneCCDC 1455093 and 1455094, tetragonal phase II (at 100 K, CCDC 1455093) and cubic phase I (at 295 K, CCDC 1455094) of 1-fluoro-adamantane. For crystallographic data in CIF or other electronic format see DOI: 10.1039/c6cp01144fBen Hassine, B et al. | 2016
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Isolation of pristine MXene from Nb4AlC3 MAX phase: a first-principles studyElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp07609aMishra, Avanish et al. | 2016
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Reactive oxygen species formed in organic lithium-oxygen batteriesElectronic supplementary information (ESI) available: Accumulation of dissolved species at the ME over longer time. See DOI: 10.1039/c5cp07145cSchwager, Patrick et al. | 2016
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Redox potential tuning by redox-inactive cations in nature's water oxidizing catalyst and synthetic analoguesElectronic supplementary information (ESI) available: Figures and Cartesian coordinates of optimized structures, Tables with interatomic distances, Mulliken spin populations, Mayer bond orders, and computed energy differences, figures with correlations for all density functionals tested. See DOI: 10.1039/c5cp07213aKrewald, Vera et al. | 2016
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Early stages of catalyst aging in the iridium mediated water oxidation reactionElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp00751aHetterscheid, Dennis G. H et al. | 2016
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Mildly reduced less defective graphene oxide/sulfur/carbon nanotube composite films for high-performance lithium-sulfur batteriesElectronic supplementary information (ESI) available: Synthesis of LGO and CGO, and their films; electrochemical performances of mrCGO/S/CNT, HI-rCGO/S/CNT, mrLGO/S, and HI-rCGO/S composite cathodes; Table S1 and Fig. S1 to Fig. S11. See DOI: 10.1039/c6cp00512hLi, Rui et al. | 2016