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41.
Anna Rakowska Robert Filipek Krzysztof Sikorski Marek Danielewski Renata Bachorczyk 《Mikrochimica acta》2004,145(1-4):183-186
The interdiffusion process in thin and thick (500nm–60µm) Au–Ni layers deposited on different substrates is studied using the EDS technique. In-depth X-ray analysis based on the Pouchou and Pichoir method is applied for obtaining the concentration profiles in nanometre scale multi-layers. A theoretical analysis using the Darken method is employed for modelling interdiffusion in the Au–Ni system. Computer simulations, where intrinsic diffusivities of the Au and Ni are functions of composition, are presented and compared with experimental results. 相似文献
42.
Matthias Schüler Thomas Kovar Hans Lischka Ron Shepard Robert J. Harrison 《Theoretical chemistry accounts》1993,84(6):489-509
Summary In this work a parallel implementation of the COLUMBUS MRSDCI program system is presented. A coarse grain parallelization approach using message passing via the portable toolkit TCGMSG is used. The program is very well portable and runs on shared memory machines like the Cray Y-MP, Alliant FX/2800 or Convex C2 and on distributed memory machines like the iPSC/860. Further implementations on a network of workstations and on the Intel Touchstone Delta are in progress. Overall, results are quite satisfactory considering the complexity and the prodigious requirements, especially the I/O bandwidth, of MRCI programs in general. For our largest test case we obtain a speedup of a factor of 7.2 on an eight processor Cray Y-MP for that section of the program (hamiltonian matrix times trial vector product) which has been parallelized. The speedup for one complete diagonalization iteration amounts to 5.9. An absolute speed close to 1 GFLOPS is found. Results for the iPSC/860 show that ordinary disk I/O is certainly not sufficient in order to guarantee a satisfactory performance. As a solution for that problem, the implementation of a fully asynchronous distributed-memory model for certain data files is in preparation.
On leave from: Bereich Informatik, Universität Leipzig, Augustusplatz 10/11, O-7010 Leipzig, Germany 相似文献
43.
The Golay-Giddings and Poiseuille equations are used to derive equations for the calculation of the maximum plate number and minimum time conditions for given columns at fixed, but selectable, outlet pressures. In addition, expressions are presented for the determination of minimum analysis times for separation problems requiring given plate numbers. In this instance, the optimum column length can be calculated as a function of outlet pressure. A Basic computer program, incorporating the equations for the various optima, together with the H-ū curves, is described. Input variables are either column length or desired plate number, column diameter, film thickness, capacity ratio of the solute, column outlet pressure, seperation temperature, and carrier gas. The carrier gas viscosity is automatically calculated in the case of hydrogen, helium, or nitrogen. For these gases, and if the solute is a n-alkane, the diffusivity of the solute in the mobile phase is calculated. In this case, the carbon number of the solute is needed in the computation. For high molecular weight polydimethylsilicone phases (e.g. SE-30), the program can approximate the diffusivity of n-alkanes in the stationary phase at the given temperature as a function of the carbon number. Of course, manually entered values of viscosity and diffusion coefficients can be included in the calculations. 相似文献
44.
The affine-scaling algorithm, first proposed by Dikin, is presently enjoying great popularity as a potentially effective means of solving linear programs. An outstanding question about this algorithm concerns its convergence in the presence of degeneracy. In this paper, we give new convergence results for this algorithm that do not require any non-degeneracy assumption on the problem. In particular, we show that if the stepsize choice of either Dikin or Barnes or Vanderbei, et al. is used, then the algorithm generates iterates that converge at least linearly with a convergence ratio of
, wheren is the number of variables and (0,1] is a certain stepsize ratio. For one particular stepsize choice which is an extension of that of Barnes, we show that the cost of the limit point is within O(/(1–)) of the optimal cost and, for sufficiently small (roughly, proportional to how close the cost of the nonoptimal vertices are to the optimal cost), is exactly optimal. We prove the latter result by using an unusual proof technique, that of analyzing the ergodic convergence of the corresponding dual vectors. For the special case of network flow problems with integer data, we show that it suffices to take = 1/(6mC), wherem is the number of constraints andC is the sum of the cost coefficients, to attain exact optimality.This research is partially supported by the U.S. Army Research Office, contract DAAL03-86-K-0171 (Center for Intelligent Control Systems), by the National Science Foundation, grant NSF-ECS-8519058, and by the Science and Engineering Research Board of McMaster University. 相似文献
45.
F. L. Vook 《辐射效应与固体损伤》2013,168(3-4):155-160
This paper was given as the opening address at the 1970 Albany International Conference on Radiation Effects in Semiconductors, and it attempts to establish a general overview of the field by concentrating on recent research developments and important unanswered questions. The continuing importance of impurity-defect interactions, of microscopic defect identification, and of the necessity for more theoretical calculations are emphasized. The rapid development of the field of ion implantation and its close relationship with radiation effects studies are pointed out. It is predicted that research in compound semiconductors will increase rapidly with close beneficial interaction with ion implantation studies. 相似文献
46.
47.
ZhiFeng Peng 《中国科学 数学(英文版)》2014,57(12):2509-2518
Langlands program is the central concern of modern number theory. In general, we think that the main tool for studying this program is the trace formula. Arthur-Selberg’s trace formula is successful in solving the endoscopic case of Langlands program. Arthur stabilized the geometric side of the local trace formula in the general case, but did not stabilize the general spectral. This paper aims to solve the general case by different method in the Archimedean case, by directly stabilizing the spectral side of the local trace formula, and obtains the stable local trace formula. 相似文献
48.
The recovery of 3D left ventricle(LV) shape using 2D echocardiography is very attractable topic in the field of ultrasound imaging. In this paper, we propose a mathematical model to determine the 3D position of LV contours extracted from multiple 2D echocardiography images. We formulate the proposed model as a non-convex constrained minimization problem. To solve it, we propose a proximal alternating minimization algorithm with a solver OPTI for quadratically constrained quadratic program. For validating the proposed model, numerical experiments are performed with real ultrasound data. The experimental results show that the proposed model is promising and available for real echocardiography data. 相似文献
49.
利用扭曲波波恩近似方法及AUTOSTRUCTURE (AS)程序,快速精确地计算了类氖Ar8+离子2s22p6、2s22p53s、2s22p53p、2s22p53d、2s2p63s、2s2p63p和2s2p63d组态的能级以及当电子碰撞能量为75.0、125.0、175.0、250.0 (Ry)时,从j能态到i能态的碰撞强度.并且与已有的研究成果进行了对比.结果表明,采用扭曲波波恩近似并结合AUTOSTRUCTURE (AS)程序的研究方法,可以成为研究原子或离子碰撞强度的有效途径。 相似文献
50.