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Understanding and control of the surface properties such as molecular orientations are of great importance in numerous applications of ionic liquids. However, there remain discrepancies among the previous experimental and theoretical studies on the surface orientation and structures of room temperature ionic liquids(RTIL) systems. In this article, the orientation of 1-butyl-3-methylimidazolium([bmin]) cation at the air/liquid interface of a characteristic RTIL, 1-butyl-3-methylimidazolium hexafluorophosphate([bmim][PF6]), was investigated by the sum frequency generation vibrational spectroscopy(SFG-VS). Detailed polarization and experimental configuration analyses of the SFG-VS spectra showed the possibility of a small spectral splitting in the CH3 symmetric stretching region, which can be further attributed to the probable existence of multiple orientations for the interfacial [bmim] cations. In addition, the(N)–CH3 vibrations were absent, ruling out the prediction by several recent molecular dynamics simulations which state that portions of the [bmim] cations orient with a standing-up(N)–CH3 group at the ionic liquid surface. Hence, new realistic theoretical models have to be developed to reflect the complex nature of the ionic liquid surface. 相似文献
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An Unprecedented Two‐Fold Nested Super‐Polyrotaxane: Sulfate‐Directed Hierarchical Polythreading Assembly of Uranyl Polyrotaxane Moieties 下载免费PDF全文
Dr. Lei Mei Dr. Qun‐yan Wu Dr. Li‐yong Yuan Dr. Lin Wang Shu‐wen An Zhen‐ni Xie Dr. Kong‐qiu Hu Prof. Zhi‐fang Chai Prof. Peter C. Burns Prof. Wei‐qun Shi 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(32):11329-11338
The hierarchical assembly of well‐organized submoieties could lead to more complicated superstructures with intriguing properties. We describe herein an unprecedented polyrotaxane polythreading framework containing a two‐fold nested super‐polyrotaxane substructure, which was synthesized through a uranyl‐directed hierarchical polythreading assembly of one‐dimensional polyrotaxane chains and two‐dimensional polyrotaxane networks. This special assembly mode actually affords a new way of supramolecular chemistry instead of covalently linked bulky stoppers to construct stable interlocked rotaxane moieties. An investigation of the synthesis condition shows that sulfate can assume a vital role in mediating the formation of different uranyl species, especially the unique trinuclear uranyl moiety [(UO2)3O(OH)2]2+, involving a notable bent [O=U=O] bond with a bond angle of 172.0(9)°. Detailed analysis of the coordination features, the thermal stability as well as a fluorescence, and electrochemical characterization demonstrate that the uniqueness of this super‐polyrotaxane structure is mainly closely related to the trinuclear uranyl moiety, which is confirmed by quantum chemical calculations. 相似文献
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Tailorable PC71BM Isomers: Using the Most Prevalent Electron Acceptor to Obtain High‐Performance Polymer Solar Cells
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Xin‐Xing Zhan Xin Zhang Si‐Min Dai Shu‐Hui Li Xu‐Zhai Lu Dr. Lin‐Long Deng Prof. Su‐Yuan Xie Prof. Rong‐Bin Huang Prof. Lan‐Sun Zheng 《Chemistry (Weinheim an der Bergstrasse, Germany)》2016,22(52):18709-18713
Despite being widely used as electron acceptor in polymer solar cells, commercially available PC71BM (phenyl‐C71‐butyric acid methyl ester) usually has a “random” composition of mixed regioisomers or stereoisomers. Here PC71BM has been isolated into three typical isomers, α‐, β1‐ and β2‐PC71BM, to establish the isomer‐dependent photovoltaic performance on changing the ternary composition of α‐, β1‐ and β2‐PC71BM. Mixing the isomers in a ratio of α/β1/β2=8:1:1 resulted in the best power conversion efficiency (PCE) of 7.67 % for the polymer solar cells with PTB7:PC71BM as photoactive layer (PTB7=poly[[4,8‐bis[(2‐ethylhexyl)oxy]benzo[1,2‐b:4,5‐b′]dithiophene‐2,6‐diyl][3‐fluoro‐2‐[(2‐ethylhexyl)carbonyl]thieno[3,4‐b]thiophenediyl]]). The three typical PC71BM isomers, even though sharing similar LUMO energy levels and light absorption, render starkly different photovoltaic performances with average‐performing PCE of 1.28–7.44 % due to diverse self‐aggregation of individual or mixed PC71BM isomers in the otherwise same polymer solar cells. 相似文献
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Xinyi Yuan 《Mathematische Zeitschrift》2015,280(3-4):1075-1084
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The influences of hyperbranched polyethylenimine(h PEI), which possesses many reactive amino end-groups, on the blending properties of bisphenol-A polycarbonate(PC) and amorphous polyamide(a PA) were systematically investigated. Scanning electron microscopy(SEM) and differential scanning calorimetry(DSC) were used to observe the effect of h PEI on morphologies of PC and a PA phases in bulk blends. While the interfacial fracture toughness between planar PC and a PA layers with and without h PEI was studied by using augmented double cantilever beam(ADCB) method. Results show that the compatibility in PC/a PA blends can be significantly improved by adding a small amount of h PEI, mainly due to the interchange reactions between the polymers leading to the formation of block copolymers, cross-linked polymers and molecules with other constitutions. The augmented double cantilever beam experiments showed that the reactive process drastically reinforced the interfacial adhesion between planar layers of PC and a PA. However, degradation takes place during annealing at 180 °C, which was responsible for the production of small molar mass species of PC. 相似文献
49.
In Situ Photocatalytically Heterostructured ZnOAg Nanoparticle Composites as Effective Cathode‐Modifying Layers for Air‐Processed Polymer Solar Cells 下载免费PDF全文
Kai Yuan Prof. Dr. Lie Chen Prof. Dr. Yiwang Chen 《Chemistry (Weinheim an der Bergstrasse, Germany)》2015,21(33):11899-11906
A heterostructured semiconductor–metal ZnO?Ag nanoparticle (NP) composite was constructed through a straightforward photocatalytic strategy by using UV irradiation of ZnO NPs and an aqueous solution of Ag precursor. The ZnO?Ag NP composites serve as an effective cathode‐modifying layer in polymer solar cells (PSCs) with increased short‐circuit current density owing to the light‐trapping effect, and improved optical and electrical conductivity properties compared with pure ZnO NPs. The Ag NPs, which are photodeposited in situ on ZnO NPs, can act as effective antennas for incident light to maximize light harvesting and minimize radiative decay or nonradiative losses, consequently resulting in the enhanced photogeneration of excitons in PSCs. Systematic photoelectron and ‐physical investigations confirm that heterostructured ZnO?Ag NPs can significantly improve charge separation, transport, and collection, as well as lower charge recombination at the cathode interface, leading to a 14.0 % improvement in air‐processed device power conversion efficiency. In addition, this processable, cost‐effective, and scalable approach is compatible with roll‐to‐roll manufacturing of large‐scale PSCs. 相似文献
50.