光谱分析采样数据重建原始信号

用光谱分析方法分析信号的采样与恢复。用三个改进的升余弦脉冲构造对称的限带频谱F(ω),经理论推导获得时域信号f(t)。采用梳状函数δ_T(t)对f(t)采样,调节T值,获得Shannon采样。应用快速傅里叶变换,计算采样的频谱F_d(ω),比较计算频谱F_d(ω)与限带频谱F(ω)的差别,讨论由采样频谱F_d(ω)重建f(t)的方法。结果发现：计算频谱F_d(ω)与限带频谱F(ω)非常相似,由采样数据可以在时域直接重建原始信号,而由频谱数据经快速逆傅里叶变换,同样能准确重建原始信号。因此,信号存储,既可以存储其采样信号,也可以存储采样信号的数字频谱。     

A study of a coadsorbate surface diffusion (Pb on C/W)

The influence of a coadsorbed submonolayer (carbon) on the diffusion of adatoms (lead) along a crystal surface (tungsten) is studied in a preliminary manner by a field electron microscope technique. Experiments show that the surface diffusion of lead is strongly affected by the coadsorption of carbon: (1) The diffusion of Pb which is easy around (110) and (111) and difficult around (100) on clean tungsten becomes easier around (100) than around (110) and (111). (2) The diffusion anisotropy on the stepped surface around (100) is changed by carbon adsorption. (3) C adatoms enhance the diffusion of Pb especially around (100). (4) The mean carbon coverage required to observe these effects is only a few hundredths of a monolayer. The dependence of the surface diffusion on such small impurity coverages is discussed.     

利用SU（2）_（q，s）量子代数的两参数变形振子实现讨论SU（2）_（q，s）相干态

利用ＳＵ（２）ｑ，ｓ量子代数的两参数变形振子实现构造出与Ｐｅｒｅｌｏｍｏｖ相干态形式不同的ＳＵ（２）ｑ，ｓ相干态．证明了ＳＵ（２）ｑ，ｓ，量子代数的表示基是正交的，并讨论了它的相干态的归一性和完备性．指出ＳＵ（２）ｑ，ｓ相干态的相干性受参数ｑ，ｓ的影响，它比单参数变形ＳＵ（２）ｑ相干态更具一般性．     

Performance analysis and precoder design for IRS-assisted MIMO system with non-linear power amplifiers

In this work, a point-to-point intelligent-reflecting-surface (IRS) assisted single input single output (SISO) model is first developed and later modified to the multiple-input multiple-output (MIMO) case. For the SISO case, the transmitter or the access point (AP) is assumed to be equipped with a non-linear memory-less power amplifier (PA). A PA is assumed to be present for each data stream at the AP or base station (BS) side for the MIMO case. For both cases, three different types of PAs (A) Soft envelope limiter (SEL), (B) Solid-state power amplifier (SSPA), and (C) Travelling wave tube amplifier (TWTA) are considered. A Bussgang decomposition of the transmitted signal is then utilized for further analysis. A modified channel model is conceived for the AP-IRS-User equipment (UE) link based on the reflecting IRS elements’ radar cross-section (RCS). For the SISO system, both perfect and imperfect geometries of IRS elements with uniformly distributed element size errors are considered. An approximate closed-form expression for the upper bound on the above system’s spectral efficiency (SE) with ideal IRS elements is derived. The expression of the SE for two special cases of (A) Infinitely large IRS and (B) Ideal PA is deduced. Approximate closed-form expressions of various quality parameters for the IRS-assisted MIMO system with ideal and non-ideal PAs are also derived and verified numerically. Maximum ratio transmission (MRT) based precoder for this system is designed assuming that the information about the BS-UE link, BS-IRS-UE link, and the non-linear PA statistics is available at the BS. A closed-form expression for the SE of this system with this precoder is then derived and verified for various parametric situations.     

萘茜光度法直接测定茶叶中的微量铜

茶叶中含有许多对人体有益的微量元素 (如Cu ,Zn ,Mn等 )而倍受人们的青睐。在中国、日本和许多其他国家都有茶文化。因此 ,有必要对茶叶中微量元素的含量进行准确测定。目前微量铜的测定方法有火焰原子吸收光谱法[1 ,2 ] 、荧光法[3,4] 、分光光度法[5～8] 和流动注射分析法[9～ 1 2 ] 。测定铜方法很多 ,由于分光光度是一种经典的方法 ,具有快速、灵敏度高 ,选择性好 ,特别是不要求贵重仪器等特点 ,它仍是检测铜重要手段之一。本文研究发现 ,在 0 1mol·L- 1 NH4Ac介质中 ,在表面活性剂SDS的存在下 ,痕量Cu(Ⅱ )与 5 ,8 二羟基 1 ,4 萘醌 (Naph)络合具有灵敏的显色反应 ,有色络合物的最大吸收波长为 330nm ,而Naph的最大吸收波长为5 1 5nm ,建立了测定痕量Cu(Ⅱ )的分光光度法。本法快速准确、灵敏度高 ,选择性好 ,可满意地测定茶叶中的微量铜。     

C80n (D2,Ih)的Jahn-Teller畸变和电子光谱

用INDO系列方法研究C80n(D2,Ih)的Jahn-Teller畸变,表明C80(D2)比C80(Ih)稳定,与实验一致;C80n(D2)未发生Jahn-Teller畸变,C80n(Ih)的部分离子发生明显的Jahn-Teller畸变,电荷对C80(Ih)稳定性有显著影响.首次计算其电子光谱,不仅得到C80(D2)与实验一致的吸收峰,还预测了C80n(D2,Ih)的电子光谱,对电子跃迁进行理论指认.C80n(D2)光谱与C80(D2)相比发生吸收峰红移,而C80n(Ih)光谱与C80(Ih)相比发生吸收峰兰移,其原因是C80n(D2)的LUMO-HOMO能隙比C80(D2)小,而C80n(Ih)的能隙则比C80(Ih)的能隙大.     

Electric quadrupole moments of the D states of alkaline-earth-metal ions

The electric quadrupole moment for the 4d(2)D(5/2) state of (88)Sr(+); one of the most important candidates for an optical clock, has been calculated using the relativistic coupled-cluster theory. This is the first application of this theory to determine atomic electric quadrupole moments. The result of the calculation is presented and the important many-body contributions are highlighted. The calculated electric quadrupole moment is (2.94 +/- 0.07)ea(2)(0), where a(o) is the Bohr radius and the electronic charge while the measured value is (2.6 +/- 0.3) ea(2)(0). This is so far the most accurate determination of the electric quadrupole moment for the above mentioned state. We have also calculated the electric quadrupole moments for the metastable 4d(2)D(3/2) state of 88(Sr(+) and for the 3d(2)D(3/2.5/2) and 5d(2)D(3/2.5/2) states of (43)Ca(+) and (138)Ba(+), respectively.     

δ-(Zn,Cr)S(111)表面上的Dzyaloshinsky-Moriya作用:第一性原理计算

根据密度泛函理论的第一性原理计算了具有非中心反演对称的异质结δ-(Zn,Cr)S(111)体系的原子结构和电子结构.Cr原子之间通过第一层S原子传递磁性相互作用.结合广义布洛赫条件,又进一步计算了反方向的自旋螺旋能量与波矢的色散关系E(q)与E(-q).E(q)与E(-q)能量之差反映了δ-(Zn,Cr)S(111)的S层与Cr层之间空间反演对称性破缺引起的DMI的大小.通过海森伯相互作用(HBI)模型与Dzyaloshinsky-Moriya作用(DMI)模型拟合第一性原理计算值,得到了Cr原子间各近邻的HBI参数J_1-J_4与DMI参数d-_1,d_2.在δ-(Zn,Cr)S(111)中,Cr原子间的耦合为M型反铁磁.DMI参数d_1为-0.53 meV,为顺时针手性DMI,在δ-(Zn,Cr)S(111)界面上有可能会产生斯格明子.本文计算表明,磁性和非磁性半导体界面有可能存在DMI,为理论研究和磁存储技术的进步开拓一个新的方向.     

2—溴甲基萘荧光和室温磷光性质研究

研究了２－溴甲基萘（２－ＢｒＭＮ）的荧光及磷光性质。２－溴甲基萘是一种优良的荧光试剂,λｅｘ／λｅｍ＝２７４／３３４ｎｍ,其浓度在１．０×１０＾－６～１．２×１０＾－４ｍｏｌ·Ｌ＾－１范围内与荧光强度呈良好的线性关系,相关系数ｒ＝０．９９９,最低检测限为４．７×１０＾－８ｍｏｌ·Ｌ＾－１。以β－环糊精（β－ＣＤ）作保护剂和１,２－二溴丙烷（ＤＢＰ）为重原子微扰剂的２－ＢｒＭＮ／β－ＣＤ／ＤＢＰ体系     

Schottky Barrier Formation at a Carbon Nanotube-Scandium Junction

Recent experiment shows that scandium （Sc） can make a good performance contact with carbon nanotubes （CNTs） to fabricate n-type field effect transistor （n-FET）. We study the Schottky barrier （SB） of scandium （Sc） and palladium （Pd） with a （8,0） single-wall CNT （SWCNT） using first-principles calculation. It is found that the p-type SB height （SBH） of the Pd-CNT contact is about 0.34 eV, which is in good agreement with the experimental data. For the Sc-CNT contact, an n-type contact is formed and the SBH is about O.08eV in agreement with the experimental observations. Our calculation demonstrates that by contacting CNT with Pd and Sc, p-FET and n-FET can be fabricated, respectively. The dipole effect at the interface is used to explain our result.     

苯基酞嗪类三环铱配合物的合成及其电致发光性能

通过含苯氧基团的苯基酞嗪衍生物配体与IrCl₃一步反应生成了三环铱配合物Ir(mppppz)₃。在480 nm光激发下其二氯甲烷溶液的发光波长为608 nm,量子产率约为0.31,磷光寿命为268 ns,其纯固态发光波长为640 nm。配合物的HOMO能级为5.14 eV,LUMO能级为2.91 eV。当Ir(mppppz)₃以2%的质量分数掺杂于PVK-PBD中做成电致发光器件后,电致发光波长为616 nm。器件的启亮电压为3.9 V,最大外量子效率为1.48%,最大亮度为1 030 cd/m²,对应的流明效率为0.81 cd/A,所发出的光的色坐标是(0.64, 0.35),接近标准红色。     

2D 1H-31P solid-state NMR studies of the dependence of inter-bilayer water dynamics on lipid headgroup structure and membrane peptides

The dynamics of hydration-water in several phospholipid membranes of different compositions is studied by 2D (1)H-(31)P heteronuclear correlation NMR under magic-angle spinning. By using a (1)H T(2) filter before and a (1)H mixing-time after the evolution period and (31)P detection, inter-bilayer water is selectively detected without resonance overlap from bulk water outside the multilamellar vesicles. Moreover the (1)H T(2) relaxation time of the inter-bilayer water is measured. Lipid membranes with labile protons either in the lipid headgroup or in sterols exhibit water-(31)P correlation peaks while membranes free of exchangeable protons do not, indicating that the mechanism for water-lipid correlation is chemical exchange followed by relayed magnetization transfer to (31)P. In the absence of membrane proteins, the inter-bilayer water (1)H T(2)'s are several tens of milliseconds. Incorporation of charged membrane peptides shortened this inter-bilayer water T(2) significantly. This T(2) reduction is attributed to the peptides' exchangeable protons, molecular motion and intermolecular hydrogen bonding, which affect the water dynamics and the chemically relayed magnetization transfer process.     

First-principles study on the electronic structure and magnetism of layered oxyselenide La2Mn2Se2O3

The electronic structure and magnetism of layered oxyselenide La(2)Mn(2)Se(2)O(3) have been studied by using first-principles calculations within the generalized gradient approximation (GGA) and GGA + U methods. The G-type antiferromagnetic (AF) state is calculated to be the most stable phase among the various magnetic configurations of interest, irrespective of the choice of the functional used, which is in good agreement with the experiments. In contrast to La(2)Fe(2)Se(2)O(3) and La(2)Co(2)Se(2)O(3), in which the AF states show metallic behavior under the GGA method, we predict the ground state of La(2)Mn(2)Se(2)O(3) is a semiconductor with an indirect band gap of ～0.52 eV via the GGA calculations. This is closely related to a closed shell configuration and large exchange splitting (～3.5 eV) in the Mn 3d states. Moreover, the magnetic properties are also discussed in terms of the calculated Heisenberg spin exchange constants, suggesting that La(2)Mn(2)Se(2)O(3) is a strong two-dimensional magnetically frustrated system.     

200 nm Supercontinuum Generated by Subpicosecond Optical Pulses and its Evolution Process Observation

200 nm superconticnumm (SC) with high flatness (<3 dB) is demonstrated with subpicosecond optical pulses generated by a passively mode-locked figure-eight-laser. The evolution process of SC under different optical pumping power is observed experimentally. Three sequential evolution stages are found: (1) SC spectrum is asymmetrically broadened due to self-phase modulation (SPM) and group velocity dispersion (GVD). (2) When the broadened spectrum exceeds the zero dispersion point, cross phase modulation (XPM) and four wave mixing (FWM) will cause symmetrical spectrum broadening. (3) stimulated Raman scattering (SRS) causes the spectrum to broaden toward long wavelength quickly when pumping power is intense enough.     

200 nm Supercontinuum Generated by Subpicosecond Optical Pulses and its Evolution Process Observation

Ｉｎｔｒｏｄｕｃｔｉｏｎ　　Ｗｈｅｎｕｌｔｒａｓｈｏｒｔｏｐｔｉｃａｌｐｕｌｓｅｓｗｉｔｈｈｉｇｈｉｎｔｅｎｓｉｔｙ（ｐｕｍｐｉｎｇｌｉｇｈｔ）ａｒｅｉｎｊｅｃｔｅｄｉｎｔｏｄｉｓｐｅｒｓｉｏｎｓｈｉｆｔｅｄｆｉｂｅｒ（ＤＳＦ）,ｄｕｅｔｏｔｈｅｎｏｎｌｉｎｅａｒｅｆｆｅｃｔｓｉｎｆｉｂｅｒｓｕｃｈａｓｓｅｌｆｐｈａｓｅｍｏｄｕｌａｔｉｏｎ（ＳＰＭ）,ｆｏｕｒｗａｖｅｍｉｘｉｎｇ（ＦＷＭ）,ｃｒｏｓｓｐｈａｓｅｍｏｄｕｌａｔｉｏｎ（ＸＰＭ）ａｎｄｓｔｉｍｕｌａｔｅｄＲａｍａｎｓｃａｔｔｅｒｉ…     

流动注射化学发光分析法测定蒽醌类药物

基于蒽醌类药物在碱性条件下对高碘酸钾-鲁米诺化学发光体系的化学发光信号有强烈的抑制作用这一现象,结合流动注射技术建立了一种直接测定蒽醌类药物的流动注射化学发光分析新方法。该方法测定大黄素的线性范围为1.0×10-8—3.0×10-7g/mL,检出限为2×10-9g/mL;测定大黄酸的线性范围为7.0×10-8—3.0×10-6g/mL,检出限为2×10-8g/mL;测定大黄素甲醚的线性范围为1.0×10-9—5.0×10-8g/mL,检出限为3×10-10g/mL。该方法操作简单快速、灵敏度高,可用于样品中蒽醌类药物含量的准确测定。     

Si(100)衬底上Mg_(0.33)Zn_(0.67)O薄膜的结构及光学性能

采用射频磁控溅射法在Si(100)衬底上制备了Mg_(0.33)Zn_(0.67)O薄膜,研究了Mg_(0.33)Zn_(0.67)O薄膜的结构和光学性能。结果表明,Si(100)衬底上Mg_(0.33)Zn_(0.67)O薄膜呈六方纤锌矿结构,薄膜沿c方向取向生长,且c轴方向晶格增大0.03 nm。薄膜呈现优异的半导体特性,激子吸收峰位于297 nm,禁带宽度约为4.3 eV。薄膜平均粒径约为20 nm。薄膜在深紫外激发下的荧光发射位于368 nm。     

图象复原的新后验方法

本文就某系统的动态图象的复原,阐述了复原的主要技术过程。提出了一种新的后验模型,即退化信息不是从退化图象本身中提取,而是从给定样本的一系列退化象中提取,从而可以用线性空不变系统的求解模型来处理非线性空变系统的图象复原问题。本文给出了用此方法所获得的处理结果。     

阿奇霉素含量的荷移光谱法测定

用分光光度法分别研究了阿奇霉素与7,7,8,8-四氰基对二次甲基苯醌(TCNQ)和氯冉酸(CL)之间的荷移反应。实验表明：阿奇霉素与TCNQ间的反应在丙酮介质中进行,形成的络合物在743和842 nm有两个吸收峰,表观摩尔吸光系数分别是2.7×104 L·mol-1·cm-1和5.0×104 L·mol-1·cm-1;阿奇霉素与氯冉酸的反应在丙酮介质中进行,形成的络合物在530 nm处有吸收峰,表观摩尔吸光系数2.4×103 L·mol-1·cm-1。用摩尔比法和等摩尔连续变化法测得荷移络合物中阿奇霉素与配体的摩尔比均为1∶2。用以上两种方法测定了阿奇霉素片剂中阿奇霉素的含量,相对标准偏差为1.0%～1.4%(n=6),回收率为97%以上,与标准方法比较结果准确。     

Temperature effect on qubit in RbCl quantum rod

We change the ellipsoidal boundary in a quantum rod (QR) into a spherical one by a coordinate transformation, and then study the influences of the ellipsoid aspect ratio and polaron radius on the probability density (PD) and oscillation period (OP) of an electron with the variational method of Pekar type (VMPT). By employing the quantum statistics theory (QST), we investigate the temperature effects on the PD and the OP. Numerical results denote that the electron probability density and the oscillation period increase (decay) with raising temperature in lower (higher) temperature regime. The electron probability density increases (decreases) with increasing ellipsoid aspect ratio when the temperature is in lower (higher) regime. The electron probability density decays (enhances) with increasing polaron radius when the temperature is in lower (higher) temperature regime. The oscillation period is an increasing function of the ellipsoid aspect ratio, whereas it is a decreasing one of the polaron radius.