Enhancement of hydrogen storage capacity on co-functionalized GaS monolayer under external electric field

Hydrogen storage properties of co-functionalized 2D GaS monolayer have been systematically investigated by first-principles calculations. The strength of the binding energy of hydrogen (H₂) molecules to the pristine GaS surface shows the physisorption interactions. Co-functionalized GaS sheet by Li, Na, K and Ca atoms enhanced the capacity of binding energies of hydrogen and strength of hydrogen storage considerably. Besides, DFT calculations show that there is no structural deformation during H₂ desorption from co-functionalized GaS surface. The binding energies of per H₂ molecules is found to be 0.077 eV for pristine GaS surface and 0.064 eV–0.37 eV with the co-functionalization of GaS surface. Additionally, in the presence of applied external electric field enhanced the strength of binding energies and it is found to be 0.09 eV/H₂ for pristine GaS case and 0.19 eV/H₂ to 0.38 eV/H₂ for co-functionalized GaS surface. Among the studied GaS monolayer is found to be the superior candidate for hydrogen storage purposes. The theoretical studies suggest that the electronic properties of the 2D GaS monolayer show the electrostatic behavior of hydrogen molecules which confirms by the interactions between adatoms and hydrogen molecules before and after hydrogen adsorption.     

移动加热源法制备单层硒化镓晶体

为了解决硒化镓(GaSe)晶体制备困难、化学性能差的问题,对GaSe晶体传统的化学汽相沉积制备方法进行了改进,采用移动加热源法制备GaSe晶体。搭建了GaSe晶体的制备装置,通过单片机精确调控制备晶体的高温炉的加热温度、移动位置等参数,并采用光学显微镜和原子力显微镜对所制备的GaSe晶体进行辅助表征。研究表明,利用移动加热源法可以制备出表面光滑且尺寸较大的单层二维GaSe晶体。由于对机电设备实现了自动精密移动,可对单层二维GaSe晶体实现高质量大批量的制备,有利于GaSe晶体在光电子学和纳电子学中的广泛应用。     

引气剂稳泡机理及其改善混凝土冻融耐久性能的研究

利用膜天平对比了两种引气剂YQJ和改性松香R在空气-水界面的单分子膜的强度，考察了掺加这两种引气剂的新拌混凝土性能和硬化混凝土的冻融耐久性能。结果表明，引气剂在空气-水界面上的单分子膜的强度直接决定了引气剂的稳泡性能。稳泡性能优异的高性能引气剂，可显著提高混凝土的冻融耐久性能。     

新保利大厦单层索网玻璃幕墙气动弹性风洞实验研究

新保利大厦东北立面玻璃幕墙造型独特、跨度大,需进行气动弹性风洞实验研究以确定其局部风荷载和总体风荷载。对该玻璃幕墙的气动弹性风洞实验相似准则、实验模型、数据处理方法和实验结果修正等进行了介绍,并对实验结果进行了分析处理,得出了应用于实际工程的数据。     

点支式玻璃建筑单层索网体系的动力特性分析

点支玻璃建筑单层索网体系是一种几何非线性较强的柔性张拉结构，其刚度受索中预应力影响较大。目前专门针对该结构动力特性方面的研究尚不多见。阐述了索网这种柔性预应力结构动力特性分析的特点，编写了相应的有限元程序，对索网自振特性的重要影响因素即几何非线性和预应力进行了研究，表明忽略几何非线性会使结构计算结果产生极大偏羞。索网的自振频率与预应力呈非线性关系，几何非线性和预应力对索网的自振特性的影响具有协同性。     

Synthesis and photoluminescence properties of ZnS nanobowl arrays via colloidal monolayer template

Two-dimensional Zinc sulfide (ZnS) nanobowl arrays were synthesized via self-assembled monolayer polystyrene sphere template floating on precursor solution surface. A facile approach was proposed to investigate the morphology evolution of nanobowl arrays by post-annealing procedure. Photoluminescence (PL) measurement of as-grown nanoarrays shows that the spectrum mainly includes two parts: a purple emission peak at 382 nm and a broad blue emission band centering at 410 nm with a shoulder around 459 nm, and a blue emission band at 440 nm was obtained after the annealing procedure. ZnS nanoarrays with special morphologies and PL emission are benefits to their promising application in novel photoluminescence nanodevice.     

Structural and electronic properties of germanene/MoS2 monolayer and silicene/MoS2 monolayer superlattices

Superlattice provides a new approach to enrich the class of materials with novel properties. Here, we report the structural and electronic properties of superlattices made with alternate stacking of two-dimensional hexagonal germanene (or silicene) and a MoS₂ monolayer using the first principles approach. The results are compared with those of graphene/MoS₂ superlattice. The distortions of the geometry of germanene, silicene, and MoS₂ layers due to the formation of the superlattices are all relatively small, resulting from the relatively weak interactions between the stacking layers. Our results show that both the germanene/MoS₂ and silicene/MoS₂ superlattices are manifestly metallic, with the linear bands around the Dirac points of the pristine germanene and silicene seem to be preserved. However, small band gaps are opened up at the Dirac points for both the superlattices due to the symmetry breaking in the germanene and silicene layers caused by the introduction of the MoS₂ sheets. Moreover, charge transfer happened mainly within the germanene (or silicene) and the MoS₂ layers (intra-layer transfer), as well as some part of the intermediate regions between the germanene (or silicene) and the MoS₂ layers (inter-layer transfer), suggesting more than just the van der Waals interactions between the stacking sheets in the superlattices.     

冷轧钢表面木薯淀粉接枝共聚物自组装膜的缓蚀性能

目的合成出木薯淀粉-苯乙烯-甲基丙烯酸甲酯接枝共聚物(CS-PE-MMA)及运用自组装技术形成在柠檬酸中对钢具有良好缓蚀性能的CS-PE-MMA分子膜。方法用扫描电子显微镜(SEM)、红外光谱(IR)表征了自组装分子膜的形貌和组成;采用动电位极化曲线、电化学阻抗谱(EIS)研究缓蚀性能。结果CS-PE-MMA在冷轧钢表面形成球斑状稳定有序而致密的分子膜。动电位极化曲线表明工作电极阴阳极反应同时被抑制,EIS谱主要呈半圆容抗弧,电荷转移电阻随CS-PE-MMA自组装温度升高,时间增大而增大,缓蚀率最高达73.04%。结论 CS-PE-MMA属于混合抑制型缓蚀剂,自组装分子膜在H3C6H5O7溶液中对冷轧钢有良好的缓蚀作用。