数控仿真中切削面计算的并行化研究

针对高离散精度模型与刀具包围体进行切削计算的情况,由于三维图像重建的计算量大,基于传统CPU实现的数控加工仿真系统不能满足实时性的三维绘制。本文利用GPU的并行性特点,提出并行方式数控仿真切削面显示算法:通过线程并行处理基于MC算法的实体构造模型中体素与刀具包围体的切削计算,根据切削后体素角点信息和边的状态查找建立的构型索引表和交点数目索引表,加速数控仿真切削面的提取,从而提高三维图像的绘制速度,满足实时性显示要求。     

Effect of additive length and chemistry on the morphology of blends of conjugated thiophenes and fullerene derivative acceptor molecules

Small molecule additives have been shown to increase the device efficiency of conjugated polymer (donor) and fullerene derivative (acceptor) based organic solar cells by modifying the morphology of the device active layer. In this paper we conduct a systematic study of how additives affect the donor‐acceptor morphology using molecular dynamics simulations of blends of thiophene‐based oligomers, mimicking poly(3‐dodecylthiophene) (P3DDT) or poly(2,2′:5′,2”‐3,3”‐didocyl‐terthiophene) (PTTT), and fullerene derivatives with additives of varying length and chemical functionalization, mimicking experimentally used additives like methyl ester additives, diiodooctane, and alkanedithiols. We find that functionalization of additives with end groups that are attracted to acceptor molecules are necessary to induce increased donor‐acceptor macrophase separation. In blends where acceptors intercalate between oligomer alkyl side chains, functionalized additives decrease acceptor intercalation. Functionalized additives with shorter alkyl segments increase acceptor macrophase separation more than additives with same chemical functionalization but longer alkyl segments. © 2015 Wiley Periodicals, Inc. J. Polym. Sci., Part B: Polym. Phys. 2015 , 53, 1046–1057     

Computational Analysis Reveals a Critical Point Mutation in the N-Terminal Region of the Signaling Lymphocytic Activation Molecule Responsible for the Cross-Species Infection with Canine Distemper Virus

Infection of hosts by morbilliviruses is facilitated by the interaction between viral hemagglutinin (H-protein) and the signaling lymphocytic activation molecule (SLAM). Recently, the functional importance of the n-terminal region of human SLAM as a measles virus receptor was demonstrated. However, the functional roles of this region in the infection process by other morbilliviruses and host range determination remain unknown, partly because this region is highly flexible, which has hampered accurate structure determination of this region by X-ray crystallography. In this study, we analyzed the interaction between the H-protein from canine distemper virus (CDV-H) and SLAMs by a computational chemistry approach. Molecular dynamics simulations and fragment molecular orbital analysis demonstrated that the unique His28 in the N-terminal region of SLAM from Macaca is a key determinant that enables the formation of a stable interaction with CDV-H, providing a basis for CDV infection in Macaca. The computational chemistry approach presented should enable the determination of molecular interactions involving regions of proteins that are difficult to predict from crystal structures because of their high flexibility.     

Positive ground state solutions for Schrödinger–Poisson system with critical nonlocal term in ℝ3

This paper is dedicated to studying the following Schrödinger–Poisson system $$\left\{\begin{array}{ll}-\mathrm{\Delta }u+V(x)u-K(x)\varphi |u{|}^{3}u=a(x)f(u),& x\in {ℝ}^3,\\ -\mathrm{\Delta }\varphi =K(x)|u{|}^5,& x\in {ℝ}^3.\end{array}\right.$$ Under some different assumptions on functions V(x), K(x), a(x) and f(u), by using the variational approach, we establish the existence of positive ground state solutions.     

80.5 MeV/u碳离子诱发铜靶的放射性剩余产物测量

高能重带电粒子能直接穿透靶原子核外电子层,与原子核发生直接碰撞,发生散裂反应,产生一系列具有放射性的剩余产物核.重带电粒子诱发靶材放射性剩余核与辐射防护和人员安全有着密切联系,当前,大部分剩余核产额主要依靠蒙特卡罗粒子输运程序进行模拟计算,其准确程度亟需通过实验测量进行准确评估.本文利用能量为80.5 MeV/u的(12)^C⁶⁺粒子对薄铜靶开展了辐照实验与伽玛射线测量,结合伽玛谱学分析方法,得出了辐照产生的18种放射性剩余产物的初始活度和产生截面值,并与PHITS模拟结果进行对比.结果表明,PHITS模拟程序对放射性剩余核种类的估计具有较高可靠性,在其绝对产额方面,与实验测量仍具有较大偏差.     

共产主义实现过程的数学刻画

指出了极限蕴含着理想与现实的统一,以此刻画了共产主义的实现过程——人类社会可以无限地趋近共产主义.把人类社会视为一个系统,提出了它的两条基本公理.借助于公理法,利用逻辑推理论证了劳动将逐渐成为人们的第一需要、劳动创造财富、人类的思想觉悟可以逐渐达到共产主义人生观等重要结论.     

利用反预报方法从截面预言近滴线丰质子核的结合能

在Origin等数据处理软件中,当实验数据较少时,自由参数的不同初始化设置会导致较大的结果差异,这为物理结果的确定带来较大不确定性.通过最小二乘法分析了345MeV/u ~(78) Kr+~9Be反应中产生的丰质子同位素的截面和结合能,并得到线性回归方程.通过回归方程,利用结合能预报部分丰质子核素的截面,以及通过实验截面对近质子滴线核素的结合能进行反预报测量.这对于近质子滴线的丰质子核素实验测量具有较好的借鉴意义.     

利用ARGO实验寻找GRBs的本底研究

位于西藏羊八井宇宙线观测站(海拔4300 m)的ARGO-YBJ实验具有高海拔、大视场、全覆盖特点,其阈能约几百个GeV,在探测高能GRBs方面具有独特的优势.ARGO-YBJ实验不能分辨光子和质子,要在大量的宇宙线事例中找出光子信号,就必须正确地估计背景事例率,这是寻找高能GRBs的关键.本文采用"等天顶角法"对ARGO实验中寻找GRBs的宇宙线本底进行了分析.由于地球的自转,天顶角随着时间的变化而变化.本文重点分析了长暴在其持续时间内天顶角的变化,从而更加准确地进行了本底估计.     

Monte Carlo simulation of electric conductivity for pure and doping fullerene (C60)

In this paper, we have used Monte Carlo (MC) method to simulate and study the temperature and doping effects on the electric conductivity of fullerene (C60). The results show that the band gap has reduced by the doping and the charge carrier transport is facilitated from valence band to conduction band by the temperature where is touched a 300 K. In this case, the conductivity reached a value of $4\times {10}^{-7}\text{S}{\text{cm}}^{-1}$. The electric conductivity of C60 can increase by the triphenylmethane dye crystal violet (CV) alkali metal to reach $4\times {10}^{-3}\text{S}{\text{cm}}^{-1}$ at 303 K. Our results of MC simulation have a good agreement with those extracted from literature [10], [33].