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141.
主要研究了一类非线性对流扩散方程的全离散特征有限元方法的两重网格算法及其误差估计.首先在网格步长为H的粗网格上计算一个较小的非线性问题,然后利用一阶牛顿迭代和粗网格解将网格步长为h的细网格上的非线性问题转化为线性问题求解.由于非线性问题的求解仅在粗网格上进行,该两重网格算法可以节省大量的计算工作量,同时具有较高的精度,证明了该两重网格算法L~2模先验误差估计结果为O(△t+h~2+H~(4-d/2)),其中d为空间维数. 相似文献
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本征值问题是自然科学中基本运算之一,对于超大矩阵的对角化是当今许多科学问题的瓶颈。在应用原子核壳模型理论研究较重的原子核结构时,因为壳模型组态太大,通常的方法是基于各种物理考虑做某些组态截断,另一个思路是利用新的算法和飞速发展的计算机资源对这些大矩阵对角化或者近似对角化。总结了本课题组近年来在壳模型哈密顿量本征值近似方面研究的主要结果,包括最低本征值半经验公式及多种外推方法、本征值与对角元的相关性等。The eigenvalue problem is one of the fundamental issues of sciences. Many research fields have been challenged by diagonalizing huge matrices. The nuclear structure theorists face this problem in studies of medium-heavynuclei in terms of the nuclear shell model, in which the configuration space is too gigantic to handle. Thus one usually truncates the nuclear shell model configuration space based on various considerations. Another approach is to make use of super computers by various algorithms, and/or to obtain approximate eigenvalues. In this paper we review our recent efforts in obtaining approximate eigenvalues of the nuclear shell model Hamiltonian, with the focus on our semi-empirical approach and a number of extrapolation approaches towards predicting the lowest eigenvalue, as well as strong correlation between the sorted eigenvalues and the diagonal matrix elements, and so on. 相似文献
147.
ZHAO JinYu LI JiaHuang ZHANG Zheng ZHANG ShuYi QU Min FANG JianWen HUA ZiChun 《中国科学:物理学 力学 天文学(英文版)》2013,(7):1301-1309
The enthalpy and conformational volume changes in the photolyses of carboxy-hemoglobin (HbCO) of human, bovine, pig, horse and rabbit are investigated by photoacoustic calorimetry. Considering the time scales of the exciting laser pulse and the receiving ultrasound transducers (PVDF films and PZT ceramics), as well as the reaction lifetimes in the photolysis processes of HbCO, the measured results are related to the geminate recombination and tertiary relaxation in photolyses of HbCO. Moreover, the quantum yields of the five mammals are also measured by laser pump-probe technique. The results show that the dynamic parameters, such as enthalpy and conformational volume changes, differ between the processes of the geminate recombination and tertiary relaxation. Also, the dynamic parameters differ among the five mammals although some of them may be consistent with each other. 相似文献
148.
In this work, the prediction of wear for revolute joint with clearance in multibody systems is investigated using a computational methodology. The contact model in clearance joint is established using a new hybrid nonlinear contact force model and the friction effect is considered by using a modified Coulomb friction model. The dynamics model of multibody system with clearance is established using dynamic segmentation modeling method and the computational process for wear analysis of clearance joint in multibody systems is presented. The main computational process for wear analysis of clearance joint includes two steps, which are dynamics analysis and wear analysis. The dynamics simulation of multibody system with revolute clearance joint is carried out and the contact forces are drawn and used to calculate the wear amount of revolute clearance joint based on the Archard’s wear model. Finally, a four-bar multibody mechanical system with revolute clearance joint is used as numerical example application to perform the simulation and show the dynamics responses and wear characteristics of multibody systems with revolute clearance joint. The main results of this work indicate that the contact between the joint elements is wider and more frequent in some specific regions and the wear phenomenon is not regular around the joint surface, which causes the clearance size increase non-regularly after clearance joint wear. This work presents an effective method to predict wear of revolute joint with clearance in multibody systems. 相似文献
149.
Nanosized Ni particles with an average diameter of about 8 nm were prepared by reducing of NiCl 2 with sodium borohydride (NaBH 4 ) in aqueous solution. By moderate annealing in protective atmosphere, the composite grew up to be 15-20 nm particles. Both of the as-prepared and annealed Ni particles were coated by a layer of manganese oxide via decomposition reaction in aqueous KMnO4 solution. Hysteresis loops of as-prepared samples show a large increase in the magnetization with decreasing temperature and an unsaturated component at high magnetic field. In contrast, the ferromagnetic characteristics of annealed one are much stronger with large magnetization and coercivity. The thermomagnetic curves verified the coexistence of ferromagnetic Ni and antiferromangetic Mn oxide phases. But there exists no exchange bias behavior in the samples, even though the interface structure between the ferromagnetic Ni core and the antiferromagnetic manganese oxides has been distinctly formed. The absence of exchange bias probably originates from the weak ferromagnetic characteristic of Ni cores. 相似文献
150.
使用赝势在HF和MP2水平上计算了M2As-和M2Br+(M=Cu,Ag,Au)的平均几何和振动频率。计算的结果表明,这些化合物呈弯曲结构(C2v)。在MP2水平上研究了电子相关对这些化合物的几何结构的修正,键角减少10°到20°。在MP2,MP3,MP4,CCSD,和CCSD(T)水平上还较详细地研究了电子相关对Au2As-的几何结构的修正。通过对这些化合物稳定性的研究,预言了Au2As-的成键可能性。 相似文献