ANALYSIS OF DISSIPATIVE STRUCTURE IN MATERIAL COMMINUTION

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Formation and thermal stability of amorphous Ni-Mo-P alloys

The experimental researches on the chemical deposition of Ni-Mo-P amorphous alloys were carried out by adding Na2 MoO4 into acidic solutions. The optimum technology conditions were obtained by orthogonal design experiments. The structures and the relationship between compositions and their thermal stability were studied by energy spectrum (EC), scanning electron micrograph and X-ray diffraction spectrum. Compared with Ni-P amorphous alloys, the Ni-Mo-P amorphous alloys have high crystallization temperature and thermal stability, and the hardness reaches its peak when the annealing temperature is 500 ℃. With the increase of the heat treatment temperature, the surface morphology of the alloys changes.     

High-temperature oxidation of SiC in a glow-discharge oxygen plasma

The oxidation kinetics and structure of the oxide scales formed on high-density SiC were studied in molecular oxygen at 740 Torr and in a glow-discharge oxygen plasma at 0.1 Torr at temperatures of 1000, 1100, and 1200°C. The monatomic oxygen formed by the glow discharge markedly increased the reaction rate and the vaporization of some of the oxidation products. The marked differences in kinetics suggest that the rate-controlling step during oxidation in molecular oxygen is the dissociation of adsorbed diatomic oxygen to the monatomic species. Films formed in molecular oxygen were mostly amorphous SiO₂ with small inclusions of SiC and graphite, whereas films formed in dissociated oxygen were primarily amorphous SiO₂ containing SiO, S₂O₃, and the coesite form of SiO₂.     

A sliding window technique for interactive high-performance computing scenarios

Interactive high-performance computing is doubtlessly beneficial for many computational science and engineering applications whenever simulation results should be visually processed in real time, i.e. during the computation process. Nevertheless, interactive HPC entails a lot of new challenges that have to be solved – one of them addressing the fast and efficient data transfer between a simulation back end and visualisation front end, as several gigabytes of data per second are nothing unusual for a simulation running on some (hundred) thousand cores. Here, a new approach based on a sliding window technique is introduced that copes with any bandwidth limitations and allows users to study both large and small scale effects of the simulation results in an interactive fashion.     

基于计算缓存方法的分子动力学程序性能优化

分子动力学数值模拟程序在现代高性能计算机上的计算效率往往很低,只能发挥系统峰值性能的几个百分点。本文对并行分子动力学程序PMD3D在联想深腾6800超级计算机上进行性能优化。通过性能分析,我们发现粒子相互作用力计算中相互关联的浮点运算严重影响了处理器的指令级并行效率,为此我们应用计算缓存的方法,将大量不规则的浮点计算进行缓存,达到一定规模后再进行向量化计算。这样使得单机性能在优化后提升4倍多,达到处理器峰值性能5.2GFlops的32.3%。最后,在深腾6800的64个节点的256个CPU上进行了并行性能测试,达到峰值运算性能1.3万亿次的27%。     

改进的分子设计方法在萃取剂选择中的应用

为解决萃取精馏中的萃取剂选择问题,本文提出一种改进的萃取剂分子设计方法,其特点是分别考察萃取剂基团在待分离体系中的溶解性能和分离选择性,结合Gani的官能团预选经验规则,对基团做一个较全面的筛选.以乙酸-水体系的萃取剂选择为实例证明,该方法有效解决了分子设计过程中的组合爆炸问题和基团选择的纯经验性的局限,提高了萃取剂选择的效率和准确性,为试验和工业生产提供了理论指导.     

用Mathematica解热量传递过程中的数学问题

本文建议用数学软件Mathematica计算热量传递过程,包括用符号运算功能推导保温层临界直径,用曲线拟合法处理传热实验数据,用积分法求取传热系数为温度函数时的换热面积,用Solve等命令求解换热和保温过程所产生的非线性方程,用DSolve命令求解非稳态传热过程产生的微分方程等等。同时绘制出有关函数图形,准确、形象地展示计算过程和结果,方便教师讲解和学生理解,避免复杂、繁琐、耗时的手工计算,提高学生利用计算机解决热量传递问题的能力。     

基于系统动力学的环境污染演化博弈问题研究

用系统动力学建立环境污染管理问题中政府管理部门与生产排污企业之间的一个混合战略演化博弈模型.仿真结果表明:非对称结构的2*2混合策略演化博弈模型不存在演化均衡.从监管部门的角度出发,改变博弈支付矩阵在演化博弈过程始终保持不变的情况,在博弈支付矩阵中考虑动态惩罚策略.结果表明,本策略的演化博弈模型存在演化稳定均衡,即Nash均衡.系统动力学为演化博弈理论的验证和应用提供一个政策仿真实验平台.     

Computational simulation of Belousov–Zhabotinskii oscillating chemical reaction

The suitability of computational simulation of the Belousov–Zhabotinskii oscillating chemical reaction by differential kinetic methodology for resolving nonlinear multi-component system is demonstrated in this work. According to the Field–KÖrÖs–Noyes mechanism and the Oregonator model, the change of the concentrations of HBrO₂, bromide ion and cerium ion are simulated. The results of computational simulation are consistent with experimental results very well. At the same time, the effect of variables and parameters, especially the rate constant on the oscillation curve, are investigated deeply. A simple method of estimating rate constants is obtained through simulation the concentrations of key components of the system, and then comparison the simulation results with the experimental ones. The reasonable rate constant is also proposed.     

Output feedback variable structure control of uncertain linear systems in the presence of actuator dynamics

A new output feedback variable structure control scheme is developed based on a novel passivity idea. This scheme may practically stabilize a class of higher‐relative‐degree uncertain linear systems, and realize output tracking and disturbance attenuation as well. The controller is composed of linear filters and a single relay, without employing real‐time exact differentiators. Under this framework, we also explain how actuator dynamics affect the closed loop behavior. A simulation example shows the simplicity and efficiency of this method. Copyright © 2009 John Wiley and Sons Asia Pte Ltd and Chinese Automatic Control Society