An improved boundary element-free method （IBEFM） for two-dimensional potential problems

The interpolating moving least-squares (IMLS) method is discussed first in this paper. And the formulae of the IMLS method obtained by Lancaster are revised. Then on the basis of the boundary element-free method (BEFM), combining the boundary integral equation (BIE) method with the IMLS method, the improved boundary element-free method (IBEFM) for two-dimensional potential problems is presented, and the corresponding formulae of the IBEFM are obtained. In the BEFM, boundary conditions are applied directly, but the shape function in the MLS does not satisfy the property of the Kronecker δ function. This is a problem of the BEFM, and must be solved theoretically. In the IMLS method, when the shape function satisfies the property of the Kronecker δ function, then the boundary conditions, in the meshless method based on the IMLS method, can be applied directly. Then the IBEFM, based on the IMLS method, is a direct meshless boundary integral equation method in which the basic unknown quantity is the real solution of the nodal variables, and the boundary conditions can be applied directly and easily, thus it gives a greater computational precision. Some numerical examples are presented to demonstrate the method.     

密度泛函理论研究ZrnCo(m=1-13)团簇的结构和磁性

利用密度泛函理论中的广义梯度近似对ZrnCo(n=1-13)团簇进行了结构优化、能量和频率的计算,研究了ZrnCo团簇的平衡几何结构、稳定性、电子性质和磁性.结果表明:Zr4Co,Zr7Co,Zr9Co和Zr12Co团簇的基态稳定性较高,是幻数团簇,尤其是Zr12Co团簇基态为Ih对称性的二十面体结构且稳定性特别高.ZrnCo团簇的磁矩随尺寸的变化可以分三个阶段:n=1-3有稳定的磁矩,从n=4开始磁矩出现振荡性的猝灭,直至n≥8磁矩完全猝灭.体系的磁矩主要来自局域d电子的贡献,ZrnCo团簇磁矩发生猝灭的主要原因是电荷转移和强烈的spd杂化效应.同时发现,过渡金属掺杂在不同特性材料中所形成的团簇体系,其结构、稳定性和磁性有些非常有意思的相似,如TMX12(TM代表过渡金属Fe或Co,X代表Si和Be)团簇、Zr13TM团簇.对此,值得进一步研究.     

以光散射技术研究啶虫脒的测定及其与DNA的相互作用

研究了啶虫脒与脱氧核糖核酸(DNA)之间的共振光散射(RLS)增强作用。加入啶虫脒导致DNA的共振光散射增强,在316.0 nm处,存在一处共振光散射增强峰。由此建立了一种以DNA为探针检测农药啶虫脒的新方法。体系的最佳条件为,实验选择了pH 1.73为适宜酸度;加入10 μg·mL-1浓度的DNA溶液的体积为 2 mL;在室温条件下,体系的反应需要30 min达到稳定;“啶虫脒-DNA-H₂SO₄”的加药顺序为最佳。该方法适用的线性范围为0～2.25 μg·mL-1,检出限为0.2 μg·mL-1,啶虫脒在河水样品中的回收率为98.0%～102.0%,并探讨了DNA与啶虫脒的相互作用机理：啶虫脒与核酸间的相互作用包含有静电引力,啶虫脒的吡啶基与DNA碱基之间的π—π堆积作用。     

左手介质矩形波导导模和表面模的场分布

从麦克斯韦方程组出发,结合电磁场的边界条件,推导出介质矩形波导导模的一般色散方程.对普通介质矩形波导和左手介质矩形波导的导模场分布分别进行了数值模拟.通过对比两种介质矩形波导的导模场分布的模拟结果,发现左手介质矩形波导Ex22模的场分布比普通介质波导Ex00模的场更集中在波导中部.同时,根据处理普通介质矩形波导的Marcatili方法.类比得到左手介质矩形波导表面模的色散方程,并数值模拟了低阶模的场分布,结果表明,能量主要集中在波导的四个角区以及波导的边缘.     

NaGdF4纳米晶多元醇法的合成、表征与NaGdF4：Eu3+和NaGdF4：Yb3+, Er3+纳米晶的发光

通过多元醇法(polyol method)合成出NaGdF₄:Eu³⁺和NaGdF₄:Yb³⁺,Er³⁺纳米晶,利用X射线衍射(XRD)、场发射扫描电镜(FE-SEM)和傅立叶变换红外吸收光谱(FT-IR)对合成的样品进行了表征。研究了Eu³⁺掺杂样品的下转换发光和Yb³⁺/Er³⁺共掺杂样品的上转换发光。对未经退火和经过退火的样品进行了比较。     

Experimental investigation on wake profile detection based on laser scattering by bubbles

The optical system for detecting wake profiles based on laser backscattering by bubbles at 180°is reported, in which the monostatic optical geometry is adopted and the power density estimation is used to process bubble scattering signal.The profiles of wakes produced by a two-blade propeller with a diameter of 46 mm at 6000 and 8000 rpm are measured using this system.It is shown that the wake region can be identified,the wake with different shapes can be distinguished,and the fine structure within wakes can be detected.Also,the repeatability of the results is tested experimentally.Results show the feasibility of this system in wake profile detection.     

脉冲放电等离子体烟气脱硫脱硝工业试验

脉冲放电等离子体烟气治理技术具有流程简单，一次投资成本低，无二次污染，可同时脱硫脱硝，形成的副产物可回收利用等特点。     

Investigation of Exotic Structure of the Largely Deformed Nucleus ^23A1 in the Relativistic-Mean-Field Model

A candidate for proton halo nucleus ^23A1 is investigated based on the constrained calculations in the framework of the de[ormed relativistic mean tield (RMF) model with the NL075 parameter set. It is shown by the constrained calculations that the ground state of ^23A1 has a large deformation that corresponds to the prolate shape. With that large deformation, the non-constrained RMF calculation predicts that there appears an inversion between the 2s1/2 [211] and ld5/2 [202] shells. The valence proton of ^23A] is weakly bound and occupies 2s1/2 [211] and ld5/2 [202] with the weights of 56% and 29%, respectively. The calculated RMS radius for matter is in agreement with the experimental one. It is also predicted that the difference between the proton RMS radius and the neutron one is very large, This suggests that there exists a proton hMo in ^23Al.     

开敞式蜗壳轴流式水轮机湍流计算及性能预估

本文在进行模型水轮机试验的基础上,完成了开敞式蜗壳轴流式模型水轮机的全流道三维定常湍流计算。计算程序以雷诺时均连续方程和N-S方程作为控制方程,选用标准κ-ε双方程湍流模型使方程组封闭。数值求解通过CIMPLEC算法实现速度、压力的分离求解,离散差分格式具有二阶精度。通过计算获得了各过流部件的流动细节,预估了水轮机的能量性能,并与试验结果进行了比较。