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961.
On the Role of the Electronic Structure of the Heteronuclear Oxide Cluster [Ga2Mg2O5].+ in the Thermal Activation of Methane and Ethane: An Unusual Doping Effect 下载免费PDF全文
Dr. Jilai Li Dr. Xiao‐Nan Wu Dr. Maria Schlangen Dr. Shaodong Zhou Dr. Patricio González‐Navarrete Dr. Shiya Tang Prof. Dr. Helmut Schwarz 《Angewandte Chemie (International ed. in English)》2015,54(17):5074-5078
The reactivity of the heteronuclear oxide cluster [Ga2Mg2O5].+, bearing an unpaired electron at a bridging oxygen atom (Ob.?), towards methane and ethane has been studied using Fourier transform ion cyclotron resonance mass spectrometry (FT‐ICR‐MS). Hydrogen‐atom transfer (HAT) from both methane and ethane to the cluster ion is identified experimentally. The reaction mechanisms of these reactions are elucidated by state‐of‐the‐art quantum chemical calculations. The roles of spin density and charge distributions in HAT processes, as revealed by theory, not only deepen our mechanistic understanding of C? H bond activation but also provide important guidance for the rational design of catalysts by pointing to the particular role of doping effects. 相似文献
962.
Mingguang Wu Jiaqin Liao Lingxiao Yu Ruitao Lv Peng Li Wenping Sun Rou Tan Xiaochuan Duan Lei Zhang Fang Li Jiyoung Kim Kang Ho Shin Ho Seok Park Wenchao Zhang Zaiping Guo Haitao Wang Yongbing Tang George Gorgolis Costas Galiotis Jianmin Ma 《化学:亚洲杂志》2020,15(7):995-1013
Carbon is a simple, stable and popular element with many allotropes. The carbon family members include carbon dots, carbon nanotubes, carbon fibers, graphene, graphite, graphdiyne and hard carbon, etc. They can be divided into different dimensions, and their structures can be open and porous. Moreover, it is very interesting to dope them with other elements (metal or non‐metal) or hybridize them with other materials to form composites. The elemental and structural characteristics offer us to explore their applications in energy, environment, bioscience, medicine, electronics and others. Among them, energy storage and conversion are extremely attractive, as advances in this area may improve our life quality and environment. Some energy devices will be included herein, such as lithium‐ion batteries, lithium sulfur batteries, sodium‐ion batteries, potassium‐ion batteries, dual ion batteries, electrochemical capacitors, and others. Additionally, carbon‐based electrocatalysts are also studied in hydrogen evolution reaction and carbon dioxide reduction reaction. However, there are still many challenges in the design and preparation of electrode and electrocatalytic materials. The research related to carbon materials for energy storage and conversion is extremely active, and this has motivated us to contribute with a roadmap on ‘Carbon Materials in Energy Storage and Conversion’. 相似文献
963.
吖啶橙—罗丹明6G—罗丹明B组合成各种混合染料体系的能量转移研究 总被引:5,自引:0,他引:5
本文对吖啶橙-罗丹明6G-罗丹明B组合成各种混合染料体系的能量转移进行了研究。结果表明,在十二烷基硫酸钠的水溶液中,吖啶橙-罗丹明6G间,罗丹明6G-;罗丹明B间,吖啶橙-罗丹明B间均能发生有效的能量转移。可以认为不仅染料单体,而且二聚体也是能量转移效率的竞争,探讨了表面活性剂对能量转移的影响。本文的工作将有助于拓宽能量转移的理论研究和应用范围。 相似文献
964.
965.
The binding of a single metal atom (Pt, Pd, Au, and Sn) nearby a single-vacancy (SV) on the graphene is investigated using the first-principles density-functional theory. On the pristine graphene (pri-graphene), the Pt, Pd, and Sn prefer to be adsorbed at the bridge site, while Au prefers the top site. On the graphene with a single-vacancy (SV-graphene), all the metal atoms prefer to be trapped at the vacancy site and appear as dopants. However, the trapping abilities of the SV-graphene are varied for different metal atoms, i.e., the Pt and Pd have the larger trapping zones than do the others. The diffusion barrier of a metal atom on the SV-graphene is much higher than that on the pri-graphene, and the Pt atom has the largest diffusion barrier from the SV site to the neighboring bridge sites. On the SV-graphene, more electrons are transferred from the adatoms (or dopants) to the carbon atoms at the defect site, which induces changes in the electronic structures and magnetic properties of the systems. This work provides valuable information on the selectivity of lattice vacancy in trapping metal atoms, which would be vital for the atomic-scale design of new metal-carbon nanostructures and graphene-based catalysts. 相似文献
966.
Bai Y Koh CG Boreman M Juang YJ Tang IC Lee LJ Yang ST 《Langmuir : the ACS journal of surfaces and colloids》2006,22(22):9458-9467
A novel surface treatment method using poly(ethyleneimine) (PEI), an amine-bearing polymer, was developed to enhance antibody binding on the poly(methyl methacrylate) (PMMA) microfluidic immunoassay device. By treating the PMMA surface of the microchannel on the microfluidic device with PEI, 10 times more active antibodies can be bound to the microchannel surface as compared to those without treatment or treated with the small amine-bearing molecule, hexamethylenediamine (HMD). Consequently, PEI surface modification greatly improved the immunoassay performance of the microfluidic device, making it more sensitive and reliable in the detection of IgG. The improvement can be attributed to the spacer effect as well as the functional amine groups provided by the polymeric PEI molecules. Due to the smaller dimensions (140x125 microm) of the microchannel, the time required for antibody diffusion and adsorption onto the microchannel surface was reduced to only several minutes, which was 10 times faster than the similar process carried out in 96-well plates. The microchip also had a wider detection dynamic range, from 5 to 1000 ng/mL, as compared to that of the microtiter plate (from 2 to 100 ng/mL). With the PEI surface modification, PMMA-based microchips can be effectively used for enzyme linked immunosorbent assays (ELISA) with a similar detection limit, but much less reagent consumption and shorter assay time as compared to the conventional 96-well plate. 相似文献
967.
968.
The sound generated by the unsteady motion of a vortex filament moving over a flat boundary with a sharp flow impedance discontinuity is studied theoretically. Theoretical results show that the vortex filament undergoes significant accelerating or decelerating motions and radiates sound at the instant when it moves across the plane of impedance discontinuity. The accelerations and decelerations of the vortex filament are shown to be the major mechanisms of sound generation. The sound so produced has a large low-frequency content such that the change in the flow impedance affects only the sound generation process but not the subsequent sound propagation to the far field. 相似文献
969.
970.
大幅度、快速光变是BL Lac天体的重要特征之一,光变研究对探索BL Lac天体内部的物理过程和机理具有特殊的意义.从大量文献中收集了BL Lac天体S5 0716+714光学V,R,I 3个波段从1994年到2008年的有效观测数据,并将这些数据30天平均后进行自回归模型(AR)的双谱估计. 双谱的等高线图和对角切片图表明,双谱估计能消除噪声的干扰来提取有用信息,抑制了噪声、提高了信噪比,有很高的分辨率,避免了伪峰的出现,能准确地认证BL Lac天体的光变周期值.由V,R,I 3个波段的双谱等高线图和对 相似文献