Non-partial-wave Coulomb-Born theory for the excitation of many-electron atomic ions II: Numerical description and application

A non-partial-wave Coulomb-Born theory is recently formulated to treat the excitation of many-electron atomic ions for impact by an arbitrary charged particle [Y.B. Duan et al., Phys. Rev. A 56, 2431 (1997)]. The multiple expansion of the transition matrix element is decomposed into the target form factor and the projectile form factor. These are the matrix elements of the tensor operators between quantum states so that any complicated wave function for the target ion can be employed. In this formal theory, an infinitesimally small positive quantity is introduced artificially to guarantee the convergence of integrals. As a supplementary part of the theory, we discuss how to choose the value of . It is found that the should be taken as functions of the momentum transfer and multipolarity . Illustrations are carried out by calculating the cross-sections for some typical transitions n _a l _a -n _b l _b of hydrogen-like ions for impact by electron, positron, and proton, respectively. The resulting cross-sections are in good agreement with ones produced by using a method available for ion targets with Slater-type orbitals [N.C. Deb, N.C. Sil, Phys. Rev. A 28, 2806 (1993)]. Comparisons demonstrate that the Coulomb-Born theory with non-partial wave analysis provides a powerful method to treat the excitation of many-electron atomic ions impact by an arbitrary charged particle. Received 6 April 1999     

Tolman length of simple droplet: Theoretical study and molecular dynamics simulation

In 1949, Tolman found the relation between the surface tension and Tolman length, which determines the dimensional effect of the surface tension. Tolman length is the difference between the equimolar surface and the surface of tension. In recent years, the magnitude, expression, and sign of the Tolman length remain an open question. An incompressible and homogeneous liquid droplet model is proposed and the approximate expression and sign for Tolman length are derived in this paper. We obtain the relation between Tolman length and the radius of the surface of tension(R_s) and found that they increase with the Rs decreasing. The Tolman length of plane surface tends to zero. Taking argon for example, molecular dynamics simulation is carried out by using the Lennard–Jones(LJ) potential between atoms at a temperature of 90 K. Five simulated systems are used, with numbers of argon atoms being 10140, 10935, 11760, 13500, and 15360, respectively. By methods of theoretical study and molecular dynamics simulation, we find that the calculated value of Tolman length is more than zero, and it decreases as the size is increased among the whole size range. The value of surface tension increases with the radius of the surface of tension increasing, which is consistent with Tolman’s theory. These conclusions are significant for studying the size dependence of the surface tension.     

面向原子制造的框架核酸研究进展

框架核酸是核酸分子通过自组装形成的一维到三维的框架结构,不仅能精准定位功能基元,还可实现在纳米甚至原子级尺度上进行力学、光学和电学等物理性质,以及单分子水平化学与生化反应的精准调控.利用框架核酸对物质进行原子级的人工自组装,可实现基本构筑单元的精准物理排布与功能化集成,进而实现器件制造,有望推动从原子到宏观的精确功能化...     

钙钛矿/硅异质结叠层太阳电池:光学模拟的研究进展

近几年,钙钛矿/硅异质结叠层太阳电池发展迅速,效率已经从13.7％提升到29.1％.由于叠层电池器件的制作工艺复杂,而叠层太阳电池中的光学损失对转换效率的影响很大,所以通过光学模拟进而获得高效电池至关重要.本文首先从商业软件和自建模型两方面概述了光学模拟的方法,接着从反射损失和寄生吸收两方面针对光学模拟研究进展进行了总...     

大气压非平衡等离子体甲烷干法重整零维数值模拟

大气压非平衡等离子体由于其独特的非平衡特性,可为甲烷和二氧化碳稳定温室气体分子活化和重整提供非热平衡和活化环境.本文采用了零维等离子体化学反应动力学模型,考虑了详细的CH4/CO2等离子体化学反应集,重点研究了反应气体CH4/CO2摩尔分数(5％—95％)对大气压非平衡等离子体甲烷干法重整制合成气和重要含氧化合物的影响...     

光伏组件国际标准概述及差异分析

文章介绍了国际上主要的光伏组件测试标准,分析了它们之间的差别,并对未来标准的发展进行了展望和分析。     

基于"台区智能管家"的APP创新管理研究

随着公共低压台区供售电量的剧增,台区管理也逐步提到了各供电企业的管理日程中来,但大部分地市的供电企业还是停留在加强实抄率和电费回收上,没有进行更深一步的研究,由于公共低压台区管理在供电企业经营管理中的位置越来越重要,加大公共低压台区的管理力度,势在必行.本文针对国网宁波供电公司北仑运检站供电台区经理使用一款叫做"台区智能管家"的APP管理模式进行研究分析.     

Cu/Ta/SiO_2/Si多层结构的纳米压痕研究

利用磁控溅射方法在Si衬底上沉积钽层以及铜层,并利用纳米压痕技术对Cu/Ta/SiO_2/Si多层膜结构进行了硬度和弹性模量的表征,研究发现多层膜结构的硬度随着薄膜厚度的增加而降低,然而弹性模量与膜厚之间并没有这样的关系。利用聚焦离子束（FIB）工艺将纳米压痕区域剖开,并通过透射电子显微镜（TEM）表征发现在纳米压痕过后,钽以及二氧化硅界面有了明显的分层现象,这一点表明层与层之间较弱的键合在相对大的负荷下遭到了破坏。     

Aggregation‐induced Emission (AIE)‐active Starburst Triarylamine Fluorophores as Potential Non‐doped Red Emitters for Organic Light‐emitting Diodes and Cl2 Gas Chemodosimeter

A new series of starburst triarylamine fluorophores SBCHO, DBCHO, CZCHO, CZCN, and SBCN, that incorporate diphenylamine or carbazole as the electron donor and dicyanovinyl or aldehyde as the electron acceptor, has been prepared and their photophysical properties are investigated. In sharp contrast to most red‐emitting dopants, which show serious aggregation‐caused quench phenomena, the new starburst triphenylamine derivatives reported here show unique enhanced emission in the solid state or upon aggregation. Organic light emitting diodes using these compounds as non‐doped host emitters and hole transporters have been fabricated. The highest external quantum yield reaches 2.09 % for CZCHO. SBCHO was investigated as a chlorine gas fluorescence (FL) solid‐film sensor for the first time. The high‐intensity emission was ‘turned off' immediately after being blown by Cl₂ gas.