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31.
Jin Xie Yun-Wei Song Dr. Bo-Quan Li Dr. Hong-Jie Peng Prof. Jia-Qi Huang Prof. Qiang Zhang 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2020,132(49):22334-22339
Polysulfide intermediates (PSs), the liquid-phase species of active materials in lithium–sulfur (Li-S) batteries, connect the electrochemical reactions between insulative solid sulfur and lithium sulfide and are key to full exertion of the high-energy-density Li-S system. Herein, the concept of sulfur container additives is proposed for the direct modification on the PSs species. By reversible storage and release of the sulfur species, the container molecule converts small PSs into large organosulfur species. The prototype di(tri)sulfide-polyethylene glycol sulfur container is highly efficient in the reversible PS transformation to multiply affect electrochemical behaviors of sulfur cathodes in terms of liquid-species clustering, reaction kinetics, and solid deposition. The stability and capacity of Li-S cells was thereby enhanced. The sulfur container is a strategy to directly modify PSs, enlightening the precise regulation on Li-S batteries and multi-phase electrochemical systems. 相似文献
32.
Dr. Shaomin Peng Dr. Qi Wei Dr. Bingzhe Wang Dr. Zhipeng Zhang Hongcheng Yang Guotao Pang Prof. Kai Wang Prof. Guichuan Xing Prof. Xiao Wei Sun Prof. Zikang Tang 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2020,132(49):22340-22346
Quasi-two-dimensional (2D) perovskites are promising candidates for light generation owing to their high radiative rates. However, strong exciton–phonon interactions caused by mechanical softening of the surface act as a bottleneck in improving their suitability for a wide range of lighting and display applications. Moreover, it is not easily available to tune the phonon interactions in bulk films. Here, we adopt bottom-up fabricated blue emissive perovskite nanoplatelets (NPLs) as model systems to elucidate and as well as tune the phonon interactions via engineering of binary NPL solids. By optimizing component domains, the phonon coupling strength can be reduced by a factor of 2 driven by the delocalization of 2D excitons in out-of-plane orientations. It shows the picosecond energy transfer originated from the Förster resonance energy transfer (FRET) efficiently competes with the exciton–phonon interactions in the binary system. 相似文献
33.
A new environment-friendly bentonite intercalation composite was successfully obtained from alumina sol intercalation. This process used industrial grade pseudo boehmite as the aluminum source and provided with the advantage of zero emission of acidic wastewater. The bentonite intercalation composite was investigated by XRF, ICP, XRD, FT-IR, BET, and pyridine-FTIR. Results indicated that the basal spacing was enlarged from 14.72 to 15.60 Å; the specific surface area increased by 128%; and the total acid content increased from 65.32 to 245.76 μmol/g. The catalytic activity of this composite was tested by alkylation of aromatics with olefins. The results show that the weak Lewis acid generated by extra-framework aluminum and specific surface area play a decisive role, while weak Brønsted acid site is not the active site for this alkylation reaction. 相似文献
34.
Yunjie Xiang Suoping Peng Shaohui Zheng 《International journal of quantum chemistry》2020,120(1):e26047
Organic solar cell of silol dithiophene based D2-A-D1-A-D2/PC71BM (D: donor part; A: acceptor part; 1 and 2 denote different units) possesses promising power conversion efficiency. Researchers have studied D2-A-D1-A-D2 molecules carefully, including the effects of the different number of terminal thiophenes, the different central moiety (D1), and the length of the alkyl chain. However, there are few investigations, especially theoretical studies, on the influences of different A (acceptor) units on the properties of D2-A-D1-A-D2 molecule. In the present work, we have designed and modeled five new D2-A-D1-A-D2 (D2 = bithiophene and D1 = silol dithiophene) donors by changing A units (A = diketopyrrolopyrrole, naphtho[1,2-c:5,6-c′]bis[1,2,5]thiadiazole, 5-fluoro-2,1,3-benzoselenadiazole, benzobisthiadiazole, and thiazolo[5,4-d]thiazole). We have applied density functional theory (DFT) and time-dependent DFT to predict their ground-state electronic structures and the UV–vis spectra, and the open circuit voltages (Vocs) of organic solar cells of D2-A-D1-A-D2/PC71BM. Based on the calculated results, we find that bithiophene thiazolo[5,4-d]thiazole siloldithiophene (BTTS) (D2 = bithiophene, A = thiazolo[5,4-d]thiazole, D1 = silol dithiophene) possesses the highest lowest unoccupied molecular orbital (−2.60 eV) and the lowest highest occupied molecular orbital (−5.33 eV) energies, and the strongest absorption in the visible region. Besides, the solar cell of BTTS/PC71BM has the highest Voc of 1.02 V. These results indicate that it may be a promising donor. In contrast, bithiophene benzobisthiadiazole siloldithiophene (BBBS) (A = benzobisthiadiazole) has low absorption strength in the visible region, which indicates that it may not be a suitable donor material. 相似文献
35.
Xu Yongjian Yu Ling Liang Lizhen Hu Chundong Xie Yahong Xie Yuanlai Jiang Caichao Liu Sheng Wei Jianglong Liu Zhimin Sheng Peng Tao Ling 《Journal of Thermal Analysis and Calorimetry》2020,139(1):527-533
Journal of Thermal Analysis and Calorimetry - According to EAST’s experimental plan, the long-pulse and high-power operation of neutral beam injector is the requirement for EAST. In this... 相似文献
36.
当前基于深度神经网络模型中,虽然其隐含层可设置多层,对复杂问题适应能力强,但每层之间的节点连接是相互独立的,这种结构特性导致了在语音序列中无法利用上下文相关信息来提高识别效果,而传统的循环神经网络虽然做出了改进,但是只能对上文信息进行利用。针对以上问题,该文采用可以同时利用语音序列中上下文相关信息的双向循环神经网络模型与深度神经网络模型相结合,并应用于语音识别。构建具有5层隐含层的模型,其中第3层为双向循环神经网络结构,其他层采用深度神经网络结构。实验结果表明:加入了双向循环神经网络结构的模型与其他模型相比,较好地提高了识别正确率;噪声对双向循环神经网络汉语识别有重要影响,尤其是训练集和测试集附加噪声类型不同时,单一的含噪声语音的训练模型无法适应不同噪声类型的语音识别;调整神经网络模型中隐含层神经元数量后,识别正确率并不是一直随着隐含层中神经元数量的增加而增加,神经元数量数目增加到一定程度后正确率出现了降低的趋势。 相似文献
37.
The Ni? Mo/Mg(OH)2 (NMM) hybrid as an efficient flame retardancy and smoke suppression composite for polypropylene (PP) was synthesized through Ni? Mo co‐precipitation on the surface of Mg(OH)2 (MH) hexagonal nanosheets. Compared to PP/MH, PP/NMM exhibited excellent smoke suppressing and flame retardancy on the heat release rate, total heat release, smoke production rate, total smoke production, CO production rate and total CO production with the same loading. The reduced hazard of PP/NMM was mainly attributed to the high physical barrier effect of compact char residues on heat, smoke and combustible gas. The mechanism study indicated that multiwalled carbon nanotubes (MWCNTs) generated from the catalytic carbonization of PP by the Ni? Mo compound could play the role of “rebar” to strengthen the char residues, avoid the generation of cracks and form highly compact char layer. Furthermore, MgO could facilitate the production of MWCNTs through changing the pyrolysis process of PP and increasing the reaction time between pyrolysis gas and Ni? Mo compound. Hence, the new Ni? Mo/MH catalyst hybrid may explore the potential for solving the tough problem of the flammability and heavy smoke of the polyolefins system. 相似文献
38.
Dr. Peng Wang Dr. Chang-xin Huo Shuyao Lang Dr. Kyle Caution Dr. Setare Tahmasebi Nick Prof. Purnima Dubey Prof. Rajendar Deora Prof. Xuefei Huang 《Angewandte Chemie (Weinheim an der Bergstrasse, Germany)》2020,132(16):6513-6520
With the infection rate of Bordetella pertussis at a 60-year high, there is an urgent need for new anti-pertussis vaccines. The lipopolysaccharide (LPS) of B. pertussis is an attractive antigen for vaccine development. With the presence of multiple rare sugars and unusual glycosyl linkages, the B. pertussis LPS is a highly challenging synthetic target. In this work, aided by molecular dynamics simulation and modeling, a pertussis-LPS-like pentasaccharide was chemically synthesized for the first time. The pentasaccharide was conjugated with a powerful carrier, bacteriophage Qβ, as a vaccine candidate. Immunization of mice with the conjugate induced robust anti-glycan IgG responses with IgG titers reaching several million enzyme-linked immunosorbent assay (ELISA) units. The antibodies generated were long lasting and boostable and could recognize multiple clinical strains of B. pertussis, highlighting the potential of Qβ-glycan as a new anti-pertussis vaccine. 相似文献
39.
研究用于校准场所中子剂量监测仪表的241Am-Be中子参考辐射场计量特性。采用蒙特卡罗方法模拟了空气自由中子参考辐射(FRNR),GB/T 14055规定的最小尺寸中子参考辐射(SRNR)和实际中子参考辐射(ARNR)中不同检验点处中子周围剂量当量率、散射中子占比和能谱分布特征。研究结果表明,空气对FRNR中的剂量率和能谱分布影响小,近似为理想中子参考辐射;采用5%含硼聚乙烯作屏蔽的最小尺寸SRNR可减少热中子,降低散射中子占比,影锥法不适用于小尺寸中子参考辐射中对散射中子的修正;ARNR中的散射中子更少、占比更低,影锥法所得散射中子占比与理论值基本一致。 相似文献
40.
采用磁控溅射方法先在玻璃衬底上室温下沉积Zn金属薄膜,接着先后在200和400 ℃温度下的硫蒸气和氩气流中进行退火,生长出 ZnS 薄膜。薄膜样品的微观结构、物相结构、表面形貌和光学性质分别采用正电子湮没技术 (PAT)、X射线衍射仪 (XRD)、扫描电子显微镜 (SEM)和紫外-可见分光光度计进行表征。该ZnS薄膜在可见光范围具有约80%的高透光率,随着硫化时间的增加,其带隙由3.55 增加到3.57 eV,S/Zn原子比从0.54上升至0.89,薄膜质量明显得到改善,相对于以前报道的真空封装硫化所制备的ZnS薄膜,硫过量问题得到了较好解决。此外,慢正电子湮没多普勒展宽谱对硫化前后薄膜样品中膜层结构缺陷研究表明,硫化后薄膜的S参数明显增大,生成的ZnS 薄膜结构缺陷浓度高于Zn薄膜。 相似文献