化学镀耐磨自润滑Ni-P复合镀层的摩擦磨损性能

利用化学复合镀技术制备了Ni-P-碳纳米管(Ni-P-CNTs)和Ni-P-无机类富勒烯WS2[Ni-P-(IF-WS2)]复合镀层,考察了复合镀层的减摩抗磨性能.结果表明,Ni-P-CNTs和Ni-P-(IF-WS2)复合镀层的减摩抗磨性能优于化学镀Ni-P和Ni-P-石墨镀层,其原因在于Ni-P-CNTs化学复合镀层中的碳纳米管具有优异力学性能和同轴石墨纳米管结构,而Ni-P-(IF-WS2)化学复合镀层中的IF-WS2具有封闭层状类富勒烯球形结构,二者均具有优异的自润滑性能.     

无机类富勒烯MoS2纳米材料的制备与表征

采用简单的沉淀法 ,利用聚乙二醇作为分散剂 ,盐酸羟铵为还原剂 ,以硫化铵为硫源合成了具有无机类富勒烯结构的纳米二硫化钼 ,通过粉末X射线衍射 (XRD)、扫描电镜 (SEM )和高分辨透射电镜 (HRTEM)等方法对其形貌和结构进行了表征 .结果表明 ,用聚乙二醇做分散剂 ,使其吸附在前驱物表面使颗粒环境呈现出一个相对隔绝的状态 ,在煅烧过程中 ,其空间位阻作用有利于MoS2 纳米颗粒形成无机类富勒烯结构 .     

Study on the covalence of Cu and chemical bonding in an inorganic fullerene-like molecule, [CuCl]20[Cp*FeP5]12 [Cu-(CH3CN)+2Cl-]5, by a density functional approach

The electronic structure and chemical bonding in a recently synthesized inorganic fullerene-like molecule, [CuCl]₂₀[Cp*FeP₅]₁₂[Cu-(CH₃CN) ⁺ ₂Cl⁻]₅ has been studied by a density functional approach. Geometrical optimization of the three basic structural units of the molecule is performed with Amsterdam Density Functional Program. The results are in agreement with the experiment. Localized MO’s obtained by Boys-Foster method give a clear picture of the chemical bonding in this molecule. The reason why CuCl can react with Cp*FeP₅ in solvent CH₃CN to form the fullerene-like molecule is explained in terms of the soft-hard Lewis acid base theory and a new concept of covalence.     

Study on the covalence of Cu and chemical bonding in an inorganic fullerene-like molecule, [CuCl]_(20)[Cp~*FeP_5]_(12)[Cu-(CH_3CN)_2~+Cl~-]_5, by a density functional approach

The titled inorganic fullerene-like molecule (hereafter abbreviated as IFM) was recently synthe-sized by Bai et al.[1], which attracts a lot of interests from inorganic and organometallic chemists, and questions are raised for this smart molecule: (ⅰ) Why CuCl can react with Cp*FeP5 in solvent CH3CN to form IFM? (ⅱ) What is the nature of chemical bond-ing? (ⅲ) What is the covalence of Cu in this mole-cule? In this paper we intend to answer these questions in terms of the soft-hard …     

双金属洋葱结构纳米Mo0.9W0.1S2的合成

0 引言 继碳富勒烯和碳纳米管的发现,1992年R.Tenne等首次在Nature上发表了具有类富勒烯和纳米管结构的WS_2,开创了非碳无机类富勒烯(Inorganic Fullerene-like,简称IF)纳米化合物研究的新领域。由于具有与富勒烯碳或碳纳米管相类似     

Characterization of Nested Hollow Inorganic Fullerene-like Tungsten Disulfide Nanoparticles Prepared by Solid-Gas Reaction

Non-carbon inorganic fullerene-like(IF) nanoscale materials have recently attracted intense interest due to their nested hollow and nanotube structures,In this letter,IF-WS2 nanoparticles prepared by solid-gas reaction were characterized by X-ray diffraction,Scanning electron microscopy and transmission electron microscopy.The results show that the IF-WS2 nanoparticles have a nested hollow closed spherical structure with diameter of 100-150mm.     

Bonding in [CuNRR’]<Subscript>4</Subscript> type clusters

Many polynuclear Cu(I) compounds have been synthesized, but the problem whether there is direct or no direct Cu-Cu bonding in these compounds is not clear. The electronic structure of [CuNRR’]₄ type clusters was investigated by using density functional methods. The results of geometrical optimization are in good agreement with experiment, and the localization of MO’s shows that there are four Cu-Cu σ bonds to form the square Cu₄ ring in addition to the four bridging Cu-N-Cu bonds. A concept of the covalence of molecular fragments is proposed to describe the bonding in these clusters.     

Metal oxide nanoclusters as drug delivery systems for an anticancer drug: a theoretical study

In this study, the reactivity and electronic sensitivity of the Be₁₂O₁₂, Mg₁₂O₁₂, and Zn₁₂O₁₂ nanoclusters were investigated for 6-thioguanine (TG) anticancer drug using density functional theory calculations at the gas phase and aqueous solution. Our results show that the electronic properties of Mg₁₂O₁₂ and Zn₁₂O₁₂ nanoclusters are significantly sensitive to the presence of TG and the nanoclusters may be a promising candidate for adsorption of this drug. The results show that all complexes are energetically favourable, especially in the aqueous phase. Also, our ultraviolet–visible results show that the electronic spectra of TG/(MO)₁₂ complexes exhibit a blue shift toward lower wavelengths (higher energies). In order to go further and gain insight into the binding features of considered (MO)₁₂ nanoclusters with TG drug, the Atoms in Molecules analysis was performed. Consequently, the results demonstrated that the Mg₁₂O₁₂ and Zn₁₂O₁₂ nanoclusters could be used as potential carriers for the delivery of TG drug.

The results represented that the Mg₁₂O₁₂ and Zn₁₂O₁₂ nanoclusters could be used as potential carriers for delivery of 6-thioguanine drug in the nanomedicine domain.     

Nanoscale Transition Metal Dichalcogenides: Structures,Properties, and Applications

Transition metal dichalcogenides (TMDs), such as MoS₂, MoSe₂, WS₂, and WSe₂, are layered materials with strong in-plane ionic-covalent bonds and weak out-of-plane van der Waals interactions, enabling formation of various nanostructures, such as nanotubes, nanoribbons, nanoflakes, and fullerene-like nanoparticles. Various remarkable properties have been found recently in these nanostructures, opening up brand new opportunities for their applications in nanoelectronics, optoelectronics, spintronics and structural materials. In this article, we present recent advances in the study of two-dimensional TMDs and their derivatives with special emphasis on structures, morphologies, properties (electronic, magnetic, thermal, mechanical), and applications (transistors, sensors, catalysts, lubricants, and composite materials). In addition, routes for modifying these properties by chemical doping, defect engineering, strain engineering, and electric fields are discussed. Our intent is to present a state-of-the-art view in this fast evolving field, with a balanced theoretical and experimental perspective.     

甲烷流量对类富勒烯碳基薄膜结构与摩擦学性能的影响

以甲烷为前驱体,采用等离子体增强化学气相沉积( PECVD)技术沉积类富勒烯碳基( FL-C∶H)薄膜于单晶硅基底材料表面。利用高分辨透射电镜( HRTEM)和拉曼光谱仪( Ramman)对薄膜的结构形貌进行表征;通过原位纳米力学测试系统和摩擦磨损试验机分析比较薄膜在不同甲烷流量的情况下的力学特征及摩擦学特性。实验结果表明：所制备的碳基薄膜具有类富勒烯纳米结构特征,甲烷流量对类富勒烯碳基薄膜( FL-C∶H)的结构和性能具有较大的影响;薄膜的弹性模量、硬度以及薄膜中的类富勒烯结构随着甲烷流量的增加而减小,但是摩擦系数对甲烷流量的变化不敏感。