Broadband excitation pulses for high‐field solid‐state nuclear magnetic resonance spectroscopy

In nuclear magnetic resonance spectroscopy, experimental limits due to the radiofrequency transmitter and/or coil means that conventional radiofrequency pulses (“hard pulses”) are sometimes not sufficiently powerful to excite magnetization uniformly over a desired range of frequencies. Effects due to nonuniform excitation are most frequently encountered at high magnetic fields for nuclei with a large range of chemical shifts. Using optimal control theory, we have designed broadband excitation pulses that are suitable for solid‐state samples under magic‐angle‐spinning conditions. These pulses are easy to implement, robust to spinning frequency variations, and radiofrequency inhomogeneities, and only four times as long as a corresponding hard pulse. The utility of these pulses for uniformly exciting ¹³C nuclei is demonstrated on a 900 MHz (21.1 T) spectrometer. Copyright © 2012 John Wiley & Sons, Ltd.     

A1Ⅱ离子3snp^1p1序列能级辐射寿命的非单调变化

本文考虑了一价铝离子双激发干扰态３ｐ４ｓ＾１ｐ１＾０对ｓｎｐ＾１Ｐ１＾０Ｒｙｄｂｅｒｇ序列的强相互作用，多组态ＨＦＲ自洽场方法计算了Ａ１Ⅱ３ｓｎｐ＾１Ｐ１０（ｎ＝３－１０）序列能级的辐射寿命，与已有的实验和理论计算结果进行了比较，结果表明该序列能级寿命随主量子数ｎ呈现非单调变化。     

High-order squeezing of pure superposition states

Ｈｉｇｈ－ｏｒｄｅｒｓｑｕｅｅｚｉｎｇｏｆｐｕｒｅｓｕｐｅｒｐｏｓｉｔｉｏｎｓｔａｔｅｓＭＡＡｉｑｕｎ（ＨａｒｂｉｎＣｏｌｌｅｇｅ，Ｈａｒｂｉｎ，１５００２０，Ｃｈｉｎａ）ＺＨＡＮＧＹａｎｘｕｎ（ＤｅｐａｒｔｍｅｎｔｏｆＰｈｙｓｉｃｓ，ＨａｒｂｉｎＮ...     

Equilibrium theory for the hard-core systems

It is found that the density expansion in the argument of the exponential function gives a fine convergence on the equation of state of the hard-sphere system. The pair distribution function and the equation of state is constructed by an intuitive kinetic theoretical method. The equation of state of the hard-core system with attractive potential is constructed semiempirically with the aid of this simple analytical result, and Kamerling-Onnes' constant of the critical point is obtained analytically.     

有机层界面对双层有机发光二极管复合效率的影响

建立了双层有机发光二极管中载流子在有机层界面复合的无序跳跃理论模型.由于有机分子材料的空间及能带结构的无序性，采用刚体模型处理有机层界面问题是不恰当的，而采用无序跳跃模型比较合理.复合效率及复合电流由载流子跳跃距离、有机层界面的有效势垒高度及该界面处的电场强度分布所决定：在双层器件ITO/α-NPD/Alq₃/Al中，当所加电压小于19.5V时，复合效率随着载流子跳跃距离的增加而增加，而大于19.5V时，复合效率随着其距离的增加而减少；复合效率随着有机层界面有效势垒高度的增加而增加； 关键词： 有机层界面 双层有机发光二极管 复合效率 有效势垒高度 无序跳跃模型     

Optimal production mix

This paper deals with a production plant in which two different products can be produced. The plant consists of three subsystemsS _i . Before or after a phase of separate processing in subsystemsS ₁ andS ₂, the two products have to be processed in subsystemS ₃. Each of these subsystems has a limited capacity.In the first part, we assume empty stocks at the beginning; at a fixed timeT in the future, certain quantitiesX _i of the two products have to be delivered to the customers. Facing linear holding costs, convex production costs, and stringent capacity constraints, the problem is to decide when to produce which product at what rate.It is shown that the optimal solution consists of up to six different regimes and that the time paths of the production rates need not be monotonic. These results, which can be obtained analytically, are also illustrated in several numerical examples.Finally, the case is considered where the terminal demand at timeT is replaced by a continuous and seasonally fluctuating demand rate. It is demonstrated that the optimal production rates show an interesting and nontrivial behavior. In particular, it may happen that, on intervals where the demand for the one product increases, the optimal production rate decreases. This is also demonstrated by computer plots in some numerical examples.The first author gratefully acknowledges support from the Austrian Science Foundation under Grant S3204 and the second author from Stiftung Volkswagenwerk. An earlier version of this paper was presented at the DGOR-NSOR Joint Conference, Eindhoven, Holland, September 23–25, 1987.     

团簇Aun+1-1、AunCr-1 (n=1-10)吸附CO的密度泛函理论研究

采用密度泛函理论对CO在阴离子团簇Aun+1-1、AunCr-1(n=1-10))表面的吸附做了系统研究.结果表明,团簇Aun+1CO-1、AunCrCO-1的基态结构是在团簇Aun+1-1、AunCr-1最低能量结构的基础上吸附CO形成; 吸附后的CO键长变长,振动频率减小,表明CO分子被活化;取值相同时,AunCrCO-1的平均结合能高,表明团簇Aun+1CO-1掺杂Cr后稳定性升高.HOMO-LOMO能隙结果表明Aun+1CO-1替代掺杂Cr原子后团簇的化学活性得到了提升,AunCrCO-1、Aun+1CO-1团簇能隙具有奇偶振荡的现象;轨道电荷分析表明CO与团簇相互作用实质是C原子与成键Au原子或Cr原子间转移电荷,CO在与团簇相互作用过程中O原子轨道电荷分布几乎没有发生变化.     

Generalized binomial and negative binomial distributions of order<Emphasis Type="Italic">k</Emphasis> by the<Emphasis Type="Italic">l</Emphasis>-overlapping enumeration scheme

In this paper, we investigate the exact distribution of the waiting time for ther-th ℓ-overlapping occurrence of success-runs of a specified length in a sequence of two state Markov dependent trials. The probability generating functions are derived explicitly, and as asymptotic results, relationships of a negative binomial distribution of orderk and an extended Poisson distribution of orderk are discussed. We provide further insights into the run-related problems from the viewpoint of the ℓ-overlapping enumeration scheme. We also study the exact distribution of the number of ℓ-overlapping occurrences of success-runs in a fixed number of trials and derive the probability generating functions. The present work extends several properties of distributions of orderk and leads us a new type of geneses of the discrete distributions.     

On the Metrical Theory of Continued Fraction Mixing Fibred Systems and Its Application to Jacobi-Perron Algorithm

 We study the metrical theory of fibred systems, in particular, in the case of continued fraction mixing systems. We get the limit distribution of the largest value of a continued fraction mixing stationary stochastic process with infinite expectation and some related results. These are analogous to J. Galambos, W. Philipp, and H. G. Diamond–J. D. Vaaler theorems for the regular continued fractions. As an application, we see that these theorems hold for Jacobi-Perron algorithm. Received September 30, 2001; in revised form January 8, 2002     

New Component of the Moduli Space M(2;0,3) of Stable Vector Bundles on the Double Space P 3 of Index Two

We study the moduli scheme M(2;0,n) of rank-2 stable vector bundles with Chern classes c ₁=0, c ₂=n, on the Fano threefold X – the double space P ³ of index two. New component of this scheme is produced via the Serre construction using certain families of curves on X. In particular, we show that the Abel–Jacobi map :HJ(X) of any irreducible component H of the Hilbert scheme of X containing smooth elliptic quintics on X into the intermediate Jacobian J(X) of X factors by Stein through the quasi-finite (probably birational) map g:M of (an open part of) a component M of the scheme M(2;0,3) to a translate of the theta-divisor of J(X).