纳米多晶铜中冲击波阵面的分子动力学研究

冲击波阵面反映材料在冲击压缩下的弹塑性变形行为以及屈服强度、应变率条件等宏观量, 还与冲击压缩后的强度变化联系. 本文使用分子动力学方法, 模拟研究了冲击压缩下纳米多晶铜中的动态塑性变形过程, 考察了冲击波阵面和弹塑性机理对晶界存在的依赖, 并与纳米多晶铝的冲击压缩进行了比较. 研究发现: 相比晶界对纳米多晶铝的贡献而言, 纳米多晶铜中晶界对冲击波阵面宽度的影响较小; 并且其塑性变形机理主要以不全位错的发射和传播为主, 很少观察到全位错和形变孪晶的出现. 模拟还发现纳米多晶铜的冲击波阵面宽度随着冲击应力的增加而减小, 并得到了冲击波阵面宽度与冲击应力之间的定量反比关系, 该定量关系与他人纳米多晶铜模拟结果相近, 而与粗晶铜的冲击压缩实验结果相差较大.     

一种视频图像规则圆目标的超分辨率位置测量方法

介绍了一种用于视频图像规则圆目标的超分辨率位置测量方法。分析了超分辨率测量的原理 ,并提出和完成了测量方案 ,取得了满意的结果。首先在目标静止时 ,连续采集多帧视频图像 ,通过叠加平均进行降噪 ;其次通过罗伯特微分算子进行边界探测 ,求出目标的大致位置 ;最后通过边界重心拟合法、边界圆拟合法和最小二乘法拟合求出目标的精确位置。理论分析和实验表明 ,完整圆目标时 ,测量精度可达 1/4像素 ;而当目标图像有缺陷时 ,边界圆拟合法和最小二乘法拟合测量误差增加较少 ,边界重心法的测量误差增加较多。在具体情况下 ,算法及参数应该作相应的调整     

航天器对接相对位置姿态自主测量方法研究

航天器间相对位置姿态的准确测量是实现自主自动对接的先决条件。将三圆标志靶安装在目标航天器上;追踪航天器用数码相机对靶拍照。设计了亚像素处理方法实时处理数字照片,可精确测定圆心像点位置和特征直径的像长;用其作为基本特征参数,基于透视投影原理,建立了求圆心物空间坐标的公式,求出靶面的平面方程,可用来求两航天器间的相对位置姿态参数和实时标定相机的可变参数。计算机仿真结果表明,测距为2m时,测圆心像点位置的误差小于0.03个像素,测距误差小于1mm,测姿态角的误差小于0.01°。该方法也适用于无人直升飞机定点着陆时自主测量其相对位姿参数。     

A primitive-variable Riemann method for solution of the shallow water equations with wetting and drying

A Riemann flux that uses primitive variables rather than conserved variables is developed for the shallow water equations with nonuniform bathymetry. This primitive-variable flux is both conservative and well behaved at zero depth. The unstructured finite-volume discretization used is suitable for highly nonuniform grids that provide resolution of complex geometries and localized flow structures. A source-term discretization is derived for nonuniform bottom that balances the discrete flux integral both for still water and in dry regions. This primitive-variable formulation is uniformly valid in wet and dry regions with embedded wetting and drying fronts. A fully nonlinear implicit scheme and both nonlinear and time-linearized explicit schemes are developed for the time integration. The implicit scheme is solved by a parallel Newton-iterative algorithm with numerically computed flux Jacobians. A concise treatment of characteristic-variable boundary conditions with source terms is also given. Computed results obtained for the one-dimensional dam break on wet and dry beds and for normal-mode oscillations in a circular parabolic basin are in very close agreement with the analytical solutions. Other results for a forced breaking wave with friction interacting with a sloped bottom demonstrate a complex wave motion with wetting, drying and multiple interacting wave fronts. Finally, a highly nonuniform, coastline-conforming unstructured grid is used to demonstrate an unsteady simulation that models an artificial coastal flooding due to a forced wave entering the Gulf of Mexico.     

Theoretical Study on Thermodynamic Properties and Hydrophilicity of Polychorinated Phenothiazines （PCPTZs）

The thermodynamic properties of 135 polychlorinated phenothiazines (PCPTZs) in the standard state are calculated using a combination of quantum mechanical computations performed with the Gaussian 03 program at the B3LYP/6-311G** level, and their octanol-water partition coefficients (logKow) are calculated based on group contributions. The chlorine substitution pattern strongly influenced the thermodynamic properties and hydrophilicity of the compounds. The thermodynamic properties of congeners also depend on the chlorine substitution pattern. The effect of chlorine substitution pattern is quantitatively studied by considering the number and position of Cl atom substitution (NPCS). The results show that the NPCS model may be used to predict the thermodynamic properties and hydrophilicity for all 135 PCPTZ congeners.     

Enhanced multi‐objective optimization of a dimpled channel through evolutionary algorithms and multiple surrogate methods

Using a multi‐objective evolutionary algorithm (MOEA) and enhanced surrogate approximations, the present study demonstrates the numerical analysis and optimization of staggered‐dimple channels. Two surrogates, the response surface approximation (RSA) model and the Kriging (KRG) model, are applied in light of the surrogate fidelity of the approximate analysis. An enhanced Pareto‐optimal front is obtained by performing local resampling of the Pareto‐optimal front, which provides relatively more accurate Pareto‐optimal solutions in the design space for each surrogate model. Three dimensionless design variables are selected, which are related to geometric parameters, namely, the channel height, dimple print diameter, dimple spacing, and dimple depth. Two objective functions are selected that are related to the heat transfer and pressure loss, respectively. The objective‐function values are numerically evaluated through Reynolds‐averaged Navier–Stokes analysis at the design points that are selected through the Latin hypercube sampling method. Using these numerical simulations two surrogates, viz, the RSA and Kriging models, are constructed for each objective function and a hybrid MOEA is applied to obtain the Pareto‐optimal front. For the particular implementation of surrogate models, it is observed that Pareto‐optimal predictions of the RSA model are better than those of the KRG model, whereas the KRG model predicts equally well at the off‐Pareto‐region (region away from the Pareto‐optimal solutions), which is not the case with the RSA model. The local resampling of the Pareto‐optimal front increases the fidelity of the approximate solutions near the Pareto‐optimal region. The ratios of the channel height to the dimple print diameter and of the dimple print diameter to the dimple pitch are found to be more sensitive along the Pareto‐optimal front than the ratio of the dimple depth to the print diameter. The decrease of the ratio of the channel height to the dimple diameter and the increase of the ratio of the dimple print diameter to the pitch lead to greater heat transfer at the expense of the pressure loss, whereas the ratio of the dimple depth to the print diameter is rather insensitive to Pareto‐optimal solutions. Pareto‐optimal solutions at higher values of the Nusselt number are associated with higher values of the pressure loss due to the increased recirculation, mixing of fluid and vorticity generation. Copyright © 2010 John Wiley & Sons, Ltd.     

High-resolution infrared spectroscopy of NNO and NNO in the 1200–3500 cm region

We present a continuation of our investigation of the second most abundant isotopic species of nitrous oxide, ¹⁴N¹⁵N¹⁶O and ¹⁵N¹⁴N¹⁶O, in the infrared (IR). Our two previous contributions looked at the 3500–9000 cm⁻¹ region for ¹⁴N¹⁵N¹⁶O and ¹⁵N¹⁴N¹⁶O, respectively, in the 3500–9000 cm⁻¹ region. The use of highly enriched isotopologue samples in this study allowed us to go further into the IR, down to 1200 cm⁻¹. A total of 2 2742 transitions have been assigned based on the effective Hamiltonian model, with 108 of them being reported here for the first time. Rovibrational analyses of 98, 101, 8, 3, 6, 1 and 1 bands for the ¹⁴N¹⁵N¹⁶O, ¹⁵N¹⁴N¹⁶O, ¹⁵N¹⁵N¹⁶O, ¹⁴N¹⁵N¹⁸O, ¹⁵N¹⁴N¹⁸O, ¹⁴N¹⁵N¹⁷O and ¹⁵N¹⁴N¹⁷O isotopologues, respectively, were also performed.     

Rotation rate of a three-wing rotor illuminated by upward-directed focused beam in optical tweezers

The optical torque and the trapping position (focal point) in optical tweezers are analyzed for upward-directed focused laser illumination using a ray optics model, considering that laser light is incident at not only the lower surface but also the side surface of a 3-wing rotor. The viscous drag force due to the pressure and the shearing stress on all surfaces of the rotor is evaluated using computational fluid dynamics. The rotation rate is simulated in water by balancing the optical torque with the drag force, resulting in 500 rpm for an SU-8 rotor with 20 μm diameter at a laser power of 200 mW. The trapping position is estimated to be 7.6 μm in the rotor with an upward-directed laser at 200 mW via an objective lens having a numerical aperture of 1.4. Both the rotation rate and the trapping position agree well with the values obtained in the experiment.     

Nonlinear optical properties of stimulated Brillouin scattering process in submerged object detection

Nonlinear optical properties of stimulated Brillouin scattering(SBS)to signal detection in water are analyzed.With the threshold characteristics,SBS only occnrs when the high power laser is focused in the SBS cell.When there is an object present in front of the focus,it leads to lower incident intensity and then SBS does not occur.The backward SBS signal depends on the focusing location.The nonlinear optical properties of SBS process in the focusing regime axe analyzed theoretically.With the object coming near to the focusing center,the backward Stokes signal rises up from zero to a maximum,and then grows to saturation.The delay time of the echo signal to pump signal can give the object location.In experiment,the peak position of varying rate of energy can give object location.