Fisher-like atomic divergences: Mathematical grounds and physical applications

Two different local divergence measures, the Fisher (FD) and the Jensen–Fisher (JFD) ones, are compared in this work by applying them to atomic one-particle densities in position and momentum spaces. They are defined in terms of the absolute and the relative Fisher information functionals. The analysis here afforded includes not only neutral atoms, but also singly-charged cations. The results are interpreted and justified according to (i) shell-filling patterns, (ii) short- and long-range behaviors of the atomic densities, and (iii) the value of the atomic ionization potential. The strengths of the FD measure, as compared to the JFD one, are emphasized.     

Investigation of odd-order nonlinear susceptibilities in atomic vapors

We theoretically deduce the macroscopic symmetry constraints for arbitrary odd-order nonlinear susceptibilities in homogeneous media including atomic vapors for the first time. After theoretically calculating the expressions using a semiclassical method, we demonstrate that the expressions for third- and fifth-order nonlinear susceptibilities for undressed and dressed four- and six-wave mixing (FWM and SWM) in atomic vapors satisfy the macroscopic symmetry constraints. We experimentally demonstrate consistence between the macroscopic symmetry constraints and the semiclassical expressions for atomic vapors by observing polarization control of FWM and SWM processes. The experimental results are in reasonable agreement with our theoretical calculations.     

Photo- and electroluminescence of nitrogen isoelectronic traps in GaAs1–xPx

The variation with temperature of the charge on the surface of NaCl single crystals has been measured directly by means of vibrating capacitor probe. The charge is negative at room temperature, in agreement with theory based on values of the free energy of vacancy formation, decreases with increase of temperature in two stages to a zero value at the isoelectric temperature, and then becomes positive. Values of isoelectric temperature obtained on surfaces are consistent with those obtained by experiments on charged dislocations, which suggests that surfaces could be used to obtain accurate values of the free energy of formation of cation and anion vacancies.     

Flow‐Injection Online Reduction Atomic Fluorescence Spectrometry Determination of Se(IV) and Se(VI) with Electrochemical Hydride Generation

Abstract

A new flow‐injection online reduction electrochemical hydride generation system for the determination of Se(IV) and Se(VI) by atomic fluorescence spectrometry (AFS) was developed. In the system, an electromagnetic induction oven was used as heating resource to reduce Se(VI) to Se(IV) and a homemade tubular electrolytic cell as hydride generator. All analytical procedures were automatically controlled by a computer. The conditions of online reduction, including temperature, HCl concentration, and reduction time, have been studied in detail. The detection limits (3σ) of Se(IV) and Se(VI) in aqueous solution were 0.26 µg L^?1 and 0.23 µg L^?1, respectively. The precision for 11 replicate measurements of 50 µg L^?1 Se(IV) and Se(VI) was 2.2% and 2.5%. This proposed method has been applied to the determination of Se(IV) and Se(VI) in springwater samples.     

Infrared Absorption Study of Some Cyclic Ureas,Cyclic Thioureas and Their N,N′-Dialkyl Derivatives

Abstract

In his communication on the detection limits for thermal emission spectroscopy of metallic species in flame media, Fassel (¹) attacks our previous statement that detection limits for Al, Be and Mo were available only for turbulent oxygen-supported hydrogen or acetylene flames. It should be borne in mind that he was referring to a preliminary communication (²) which naturally does not carry an extensive bibliography. It should also be noted that we were concerned, in context, with a comparison of the separated flame with conventional flames, not with highly unconventional flames such as those to which he refers. Whilst the point with which he takes issue was a very minor one, incorporated in our preliminary communication mainly as an “aside”, we firmly disagree with his observation. The flame he refers to (³) (⁴) is, in fact, a diluted oxy-acetylene flame which is supported by venting some air (and therefore nitrogen) to dilute the fuel-oxygen mixture. Fassel's communication (¹) erroneously refers to this as a 'premixed oxy-acetylene flame', whereas elsewhere (⁵) it is described more correctly as an oxygen-nitrogen-acetylene flame. The burner he long-pathlength carbonaceous flames (¹⁰). They also allow more sensitive molecular emission spectroscopy of sulphur in an air-hydrogen flame (¹¹), etc. We hope that this unfortunate correspondence will not distract attention from the main issue of our previous or previous preliminary communication on the separated nitrous oxide-acetylene flime.     

High pressure and emission spectra of Eu3+ in L-EuBO3

Effects of the high pressure on the emission spectra of Eu³⁺-activated L-EuBO₃ were considered at room temperature up to 100 kbar. The position of five 0–2 lines in the ⁵D₀→⁷F₂ transition region was determined. The pressure does not have the same effect on all these lines. In four of them, high pressure induced a red shift with different shift rates:+0.0022,+0.0035,+0.0034 and+0.0027 nm kbar^?1, respectively, whereas in the last one, high pressure induced a blue shift with shift rate?0.0034 nm kbar^?1. Possible reasons for the mentioned pressure effects on the line positions were considered.     

Manothermosonication (MTS) treatment by a continuous-flow system: Effects on the degradation kinetics and microstructural characteristics of citrus pectin

Modified pectin (MP) was reported to have increased bioactivities compared with the original one. However, traditional modification methods such as using an acidic solvent with heating are not only costly but causing severe pollution as well. In this study, manothermosonication (MTS) with a continuous-flow system was utilized to modify citrus pectin. The citrus pectin (5 g/L) treated by MTS (3.23 W/mL, 400 kPa, 45 °C) exhibited lower molecular weight (Mw, 248.17 kDa) and PDI (2.76). The pectin treated by MTS (400 KPa, 45 °C, 5 min) exhibited a narrower Mw distribution and lowered more Mw (48.8%) than the ultrasound(US)-treated (23.8%). Pectin degradation data fitted well to kinetic model of 1/Mw_t −1/Mw₀ = kt (45–65 °C). A lower activation energy of 13.33 kJ/mol was observed in the MTS treatment compared with the US-treated (16.38 kJ/mol). The MTS-treated pectin lowered the degree of methoxylation (DM), mol% of rhamnose and galacturonic acid (GalA) while increased mol% of galactose (Gal), xylose (Xyl), and arabinose (Ara). The ¹H and ¹³C nuclear magnetic resonance showed that MTS could not alter the primary structures of citrus pectin. However, an elevated (Gal + Ara)/Rha and reduced GalA/(Rha + Ara + Gal + Xyl) molar ratios after MTS suggested that MTS resulted in more significant degradation on the main chains and less on the side chains of pectin, in agreement with the result of atomic force microscope. Moreover, the MTS-treated pectin exhibited a higher 1,1-diphenyl-2picryl hydrazyl radical scavenging capacity compared with original pectin.     

粉末晶体(ZrO2)x(Bi2O3)1-x(x=1.0, 0.97) 晶体结构分析

为了确定ZrO2和(ZrO2)0.97(Bi2O3)0.03的晶体结构和原子热振动各向同性温度因子B,对该粉末晶体进行X射线衍射实验,建立了晶体结构模型,进行晶体结构分析。首先,采用共沉淀法和高温固相烧结法制备了纳米氧化锆ZrO2和(ZrO2)0.97(Bi2O3)0.03粉末晶体,接着,使用X射线测试仪对两种样品进行了衍射实验（XRD）,利用Rietveld 精修方法的 RIETAN-2000程序对所得实验结果进行了晶体结构分析,获得了晶体结构参量和原子热振动各向同性温度因子B。通过Maximum Entropy Method（MEM）解析得到了粉末晶体(ZrO2)x(Bi2O3)1-x(x=1.0,0.97)的等高电子密度分布可视化图谱。结果表明,(ZrO2)0.97(Bi2O3)0.03的晶胞体积比ZrO2的晶胞体积大分别为140.6850 Å3和140.5637Å3;ZrO2晶体的原子热振动各向同性温度因子B(Zr)、BO(1)、BO(2)和 B（Bi）分别为0.690、0.269、 0.178 和 0 Å2,(ZrO2)0.97(Bi2O3)0.03晶体的分别为0.460 、0.583 、0.121 和0.581 Å2。 确定了(ZrO2)0.97(Bi2O3)0.03的晶体结构属于单斜晶系,实现了等高电子密度分布三维（3D）和二维（2D）的可视化,进一步确定了晶体结构和原子位置。     

原子分子光子系统的耗散相互作用和退相干

原子分子系统与量子化的电磁场或光子模式耦合的系统是非相对论量子力学理论研究和实验研究的主要对象和模型. 现实系统必然与外界环境耦合,且即便原子隔绝较好、光学腔壁品质因子足够高,原子系统也不等价于少数几个能级构成的简单模型：它仍然有不为零的几率跃迁到不可控的能级空间、与原子相互作用的自由空间真空场的量子效应也必须考虑. 本文将结合开放量子系统理论的基本要素与原子光子的基本模型,对原子分子系统在电磁场中发生的耗散以及量子退相干过程做简单综述,并重点介绍描述量子系统退相干过程的主流理论工具——主方程.     

掺Perylene的PVK薄膜荧光谱及发光机理

用高荧光效率的有机染料芘(perylene)掺杂聚乙烯咔唑(PVK),其荧光光谱与芘的发射光谱基本一致,而且亮度比纯芘发光提高十多倍,说明发光主要来自芘分子,并在PVK和perylene之间存在十分有效的能量传递或电荷转移过程,荧光谱强度随掺杂浓度的变化关系说明存在一个最佳的掺杂浓度比.分析PVK和perylene之间可能发生的能量转移过程,认为从PVK到perylene这种能量转移与实验不符;分析PVK和perylene薄膜的光致发光过程,认为从(PVK+)→(perylene+)和从(PVK-)→(p