利用改进的ADI方法实现单机千万节点的油水两相渗流数值模拟

针对实际油藏的非均质分布特征及其复杂的边界条件,本文通过引入迭代参数的压缩因子和放大因子,对现有的交替方向迭代法(ADI)进行改进,提出一种适用于大规模油藏数值模拟的新算法．改进的ADI 方法计算精度可靠,且与现有的算法相比计算效率有所提高．更为关键的是,ADI 算法将求解三维压力方程的七对角矩阵分解为三个方向的三对角矩阵依次迭代求解,所需的运算存储量大幅减少,最大的计算规模有了大幅的提升．使用改进的ADI 方法,在单机上成功实现了千万节点的油水两相渗流数值模拟．计算实例表明,在同等单机硬件条件下,改进ADI 算法的最大计算规模是现有算法的1.7 倍以上．     

飞控系统控制信息自动采集处理模块与自测试设计

介绍一种机载飞控系统飞控计算机对各种控制信息（包括离散量、模拟量和串行数据）进行数字化控制、实时采集、监控和处理的接口模块设计方法,从工程应用角度出发,阐述了模块的设计思路以及工程实现,给出原理框图和测试流程。在某型飞机的实际应用中,实现了32路离散量输入输出、16路模拟量输入输出、6路ARINC429串行数据收发、4路ARINC422串行数据收发以及4路ARINC232串行数据收发的功能,自测试覆盖率达100%。因该模块的接口形式和接口数量可根据实际需要进行增减,故具有很强的典型性和通用性,可适用于各类型的机载飞控系统。     

极坐标系统下进行直角坐标扫描的离子束抛光

在离子束抛光设备研制过程中,离子源扫描运动方式的选择是很关键的,一般分为直角坐标方式扫描和极坐标方式扫描两种。根据两种扫描方式的特点,在极坐标系统下进行直角坐标扫描方式加工。该种方法采用直角坐标扫描方式下的驻留时间计算,算法相对简单。该种方法在极坐标系统下进行加工,同等情况下可加工圆形镜面的口径比直角坐标系统下更大些;而且离子源的可移动区域是一条直线,其余地方可以摆放其他设备,空间利用率较高。对这种新思路进行仿真分析,证实了其具有可行性。     

Multicompartment Micellar Solutions in Shear: A Dissipative Particle Dynamics Study

Summary: Dissipative particle dynamics simulations were performed to study the effect of shear on the rheological behavior of multicompartment micellar solutions, demonstrating that both shear thickening and thinning can occur, and the macroscopic behavior was elucidated at a molecular level. In addition, a novel shear‐induced morphology of “sphere‐on‐rod” was observed. This work provides useful information towards a complete understanding of the properties and morphologies of multicompartment micelles that is useful for future rational synthesis of novel micelles.

Shear‐induced morphological transitions and rheological behavior in multicompartment micellar solutions formed from star triblock copolymers.     

Self‐Assembly of Two Agents in a Core‐Shell‐Corona Multicompartment Micelle Studied by Dissipative Particle Dynamics Simulations

Summary: Dissipative particle dynamics simulations are performed on the distributions of two agents in a core‐shell‐corona multicompartment micelle. The simulated results show that when the agents are weakly hydrophobic, their distributions in the multicompartment micelle are largely affected by the interactions between the agents and the blocks; while for strongly hydrophobic agents, the self‐assembly of solubilized species in the micelle is also affected largely by the interactions between the species. This work confirms that a multicompartment micelle can store two agents within separate nanoscopic compartments simultaneously, and shows that the distributions of the agents can be tailored easily by changing the interactions presented. This provides molecular‐level information that is useful for the future rational design of new micellar systems with tailored properties.

Simulated cross sections of the multicompartment micelles with strongly hydrophobic solubilized agents (the solvent and block A are omitted for clarity, block B is dark gray, block C is light gray, agent P is white, and agent Q is black).     

单壁碳纳米管储氢行为的模拟计算研究

利用碳纳米管储氢已经成为了纳米科技领域中的一项研究热点.为了认识碳纳米管的动态储氢过程,本文借助于分子动力学方法,对单壁碳纳米管的储氢行为进行了模拟计算,其结果生动逼真,并得出了储氢的如下结论:被吸附的氢分子主要出现在管内和管外的边缘附近;管内氢分子的分布出现分层现象,且管径越小,则靠近管壁的氢分子分层现象越明显;在管内外靠近管壁处的氢分子与管壁有一定的空隙.这为进一步研究碳纳米管的储氢机理和储氢容量等问题提供了必要的依据.     

Applications of Computer Algebra in Solving Nonlinear Evolution Equations

With the use of computer algebra, the method that straightforwardly leads to travelling wave solutions is presented. The compound KdV--Burgers equation and KP--B equation are chosen to illustrate this approach. As a result, their abundant new soliton-like solutions and period form solutions are found.     

Realization of Quantum Circuits in Fock Space

In this letter, by using the method we offered in our paper [L. Ma and Y.D. Zhang, Commun. Theor. Phys. (Beijing, China) 36 (2001) 119], some extended quantum logic gates, such as quantum counter, quantum adder, are studied and their expressions are given. It may be useful for us to study the more complicated quantum logic circuits deeply.     

颗粒Reynolds正应力轨道模型及后台阶两相流动数值模拟

用随机过程理论建立气固两相耦合脉动量Lagrange方程,并建立了气固两相流随机颗粒轨道模型中颗粒Reynolds正应力的Lagrange方程.将新的模型运用于各向同性的湍流衰减的流场中,模拟颗粒的湍流扩散特性,与文[1]中的模型和实验结果作比较,并使用新模型模拟了后台阶两相流动.     

Ordering of Diblock Copolymer Materials on Patterned Substrates: a Single Chain in Mean Field Simulation Study

Summary: The directed assembly of diblock copolymers on patterned substrates is a way to create nanoscopically structured materials. We study the structure and kinetics of diblock copolymers on patterned substrates by simulating a large ensemble of independent chains in an external field. This external field depends on the density created by the ensemble of molecules and it is frequently updated as to mimic the instantaneous interactions of a molecule with its neighbors. This approximate, particle-based field theoretical method allows (i) to incorporate arbitrary chain architecture (ii) to include fluctuations and (iii) the explicit propagation of the chain conformations in time permits us to study the kinetics of structure formation. The factors that control the accuracy of the method are quantitatively discussed and the reconstruction of the soft morphology at substrate patterns that deviate from the periodic morphology of the diblock in the bulk are illustrated.