X射线衍射仪功能扩展的研究

通过软件实现了用 Ｐ Ｃ 机调用日本 Ｒｉｇａｋｕ 公司生产的 Ｄ／ ｍａｘ 一类 Ｘ 射线衍射仪测量数据，利用 Ｐ Ｃ 机的复杂计算功能，使原有仪器也可以进行新的结构分析工作，扩展了仪器的功能。     

The minimum norm method for the determination of the charge density from elastic electron scattering data

Unphysical behavior in the QR algorithm based least squares determination of the expansion coefficients of the charge density obtained from limited information about the charge form factor occurs when the spread of the singular values in the matrix relating these quantities becomes too large. Setting the smallest singular values equal to zero in the singular value decomposition used in the minimum norm method yields a much more reasonable determination of the charge density. Increasing the size of the basis without increasing the range of the prior information about the charge form factor leads to ambiguities in the determination of the charge density. Numerical results in an analytic model are presented.     

Nonlinear waves generated by a steadily moving line load on an elastic plate

The steady-state response of an infinite plate to a steadily moving line load is studied. The nonlinear plate theory of Herrmann is used. The plate response is governed by a set of nonlinear differential equations and, in addition, must satisfy the “radiation” conditions. Appropriate radiation conditions for the present nonlinear problem are developed. Exact solutions representing nonlinear waves generated by the moving load are constructed.     

Two methods for determining impact-force history on elastic plates

Two methods are presented to detect the impact-force history on elastic plates. The first method involves construction of a Greens function to relate the strain responses to an impact force acting axisymmetrically on a circular plate. The classical plate theory and a series of Bessel functions were used to obtain the Greens functions in the time domain. The gradient projection method was employed to search for the optimal force history. Examples using circular plates with free and fixed boundary conditions are demonstrated. On the other hand, the second method is purely experiment-based and involves no Greens function. Thus, this method can be applied to structures of various geometries, boundary conditions and material properties. The very satisfactory agreement between the measured and the detected force histories using both methods shows that they are reliable for impact-force determination purposes.     

Implicit weighted essentially non‐oscillatory schemes for the incompressible Navier–Stokes equations

A class of lower–upper/approximate factorization (LUAF) implicit weighted essentially non‐oscillatory (ENO; WENO) schemes for solving the two‐dimensional incompressible Navier–Stokes equations in a generalized co‐ordinate system is presented. The algorithm is based on the artificial compressibility formulation, and symmetric Gauss–Seidel relaxation is used for computing steady state solutions while symmetric successive overrelaxation is used for treating time‐dependent flows. WENO spatial operators are employed for inviscid fluxes and central differencing for viscous fluxes. Internal and external viscous flow test problems are presented to verify the numerical schemes. The use of a WENO spatial operator not only enhances the accuracy of solutions but also improves the convergence rate for the steady state computation as compared with using the ENO counterpart. It is found that the present solutions compare well with exact solutions, experimental data and other numerical results. Copyright © 1999 John Wiley & Sons, Ltd.     

Application of macroautoradiography and instantimage in radiopharmaceutical research

The evaluation of the pharmacokinetics of pure, beta radiopharmaceuticals is not possible with scintigraphy. Both whole-body autoradiography (WBAR) and Packard Instantimager, a device for rapid imaging, were used to study the whole body distribution of γ- and β-emitting radionuclides (^99mTc-MDP,^99mTc-sulfur colloid, or¹⁸⁸Re-HEDP), and results obtained from both methods were compared. The biodistribution of^99mTc-MDP and¹⁸⁸Re-HEDP were seen mainly in bones including skull, spine, and vertebrae of spine and cardiac and skeletal muscles. The^99mTc-sulfur colloid localized in liver, bone marrow, and spleen. The resolution of WBAR is superior than that of Packard Instantimager. However, the advantage of Packard Instantimager is that rapid imaging within few minutes is possible with it, while WBAR imaging requires several hours to days.     

New and Simple Syntheses of the Attractants of the Female Melon Fly,Dacus cucurbitae

The attractant of the female melon fly, (E)-6-nonenyl acetate, and the two analogs, (E)-7-dodecenyl acetate and (E)-7-decenyl acetate were synthesized via hydrozirconation to control the regioselective coupling reactions and resulted in good yields.     

Synthesis, characterization, and applications of shaped single crystals

In this paper we shall review techniques for the growth of single crystal, mostly of insulating material, which are shaped during the growth process. In particular, we shall focus on the growth of single-crystal fibers of optically activated materials; the emphasis will be placed on the so-called Laser Heated Pedestal Growth (LHPG) method of pulling crystalline fibers. LHPG offers a number of logistical advantages which can be exploited as a tool for materials research. Progress in the synthesis of materials using LHPG is described, as are spectroscopic techniques which are employed in characterizing the optical and physical properties of the crystal fibers obtained by this method. Fiz. Tverd. Tela (St. Petersburg) 41, 770–773 (May 1999) Published in English in the original Russian journal. Reproduced here with stylistic changes by the Translation Editor.     

Morphology and temperature responsiveness–swelling relationship of poly(N‐isopropylamide–chitosan) copolymers and their application to drug release

Poly [N‐isopropylacrylamide (NIPAAm)–chitosan] crosslinked copolymer particles were synthesized by soapless emulsion copolymerization of NIPAAm and chitosan. An anionic initiator [ammonium persulfate (APS)] and a cationic initiator [2,2′‐azobis(2‐methylpropionamidine)dihydrochloride (AIBA)] were used to initiate the reaction of copolymerization. The chitosan–NIPAAm copolymer synthesized by using APS as the initiator showed a homogeneous morphology and exhibited the characteristic of a lower critical solution temperature (LCST). The copolymer synthesized by using AIBA as an initiator showed a core–shell morphology, and the characteristic of LCST was insignificant. The LCST of the chitosan–NIPAAm copolymer depended on the morphology of the copolymer particles. In addition, the chitosan–NIPAAm copolymer particles were processed to form copolymer disks. Then, the effect of various variables such as the chitosan/NIPAAm weight ratio, the concentration of crosslinking agent, and the pH values on the swelling ratio of chitosan–NIPAAm copolymer disks were investigated. Furthermore, caffeine was used as the model drug to study the characteristics of drug loading of the chitosan–NIPAAm copolymer disks. Variables such as the chitosan/NIPAAm weight ratio and the concentration of the crosslinking agent significantly influenced the behavior of caffeine loading. Two factors (pore size and swelling ratio) affected the behavior of caffeine release from the chitosan–NIPAAm copolymer disks. © 2004 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 42: 3029–3037, 2004