三元配合物Ho(Et2dtc)3(phen)的合成及其热化学性质

改进文献方法,以铜试剂(NaEt2dtc·3H2O)和邻菲咯啉(o-phen·H2O)与低水合氯化钬(HoCl3·3.58H2O)在无水乙醇中反应,制得三元固态配合物.化学分析和元素分析确定该配合物的组成为Ho(Et2dtc)3(phen).IR光谱表明配合物中Ho3 与3个NaEt2dtc中的6个硫原子双齿配位,同时与o-phen中的2个氮原子双齿配位,可推测其配位数为8.用微量热量计测定了298.15 K下液相生成反应的焓变△rHm (1),为(-14.697±0.0376)kJ·mol-1,通过合理的热化学循环计算了固相生成反应焓变△rHm (s),为(117.504±0.619)kJ·mol-1;改变反应温度,研究了配合物的液相生成反应的热力学性质.配合物的恒容燃烧能△cU用精密转动弹热量计测定为(-18687.64±8.22)kJ·mol-1,其标准燃烧焓△cHm 和标准生成焓△fHm 经计算分别为(-18706.85±8.22)和(-70.01±9.37)kJ·mol-1.     

Shell Evolution Study for New Magic Number N =32 via Isochronous Mass Spectrometry

Recent results and progress of mass measurements of neutron-rich nuclei utilizing Isochronous Mass Spectrometry (IMS) based on the HIRFL-CSR complex at Lanzhou are reported. The nuclei of interest were produced through projectile fragmentation of primary 86Kr ions at a realistic energy of 460.65 MeV/u. After in-flight separation by the fragment separator RIBLL2, the fragments were injected and stored in the experimental storage ring CSRe, and their masses were determined from measurements of their revolution times. The re-determined masses were compared and evaluated with other mass measurements, and the impact of these evaluated masses on the shell evolution study is discussed.     

Theoretically Rational Designs of Transport Organic Semiconductors Based on Heteroacenes

A Marcus electron transfer theory coupled with an incoherent polaron hopping and charge diffusion model in combining with first‐principle quantum chemistry calculation was applied to investigating the effects of heteroatom on the intermolecular charge transfer rate for a series of heteroacene molecules. The influences of intermolecular packing and charge reorganization energy were discussed. It was found that the sulphur and nitrogen substituted heteroacenes were intrinsically hole‐transporting materials due to the reduced hole reorganization energy and the enhanced overlap between HOMOs. For the oxygen‐substituted heteroacene, it was found that both the electronic couplings and the reorganization energies for holes and electrons were comparative, indicating the application potential of ambipolar devices. Most interestingly, for the boron‐substituted heteroacenes, theoretical calculations predicted a promising electron‐transport material, which is rare for organic materials. These findings provide insights into rationally designing organic semiconductors with specific properties.     

微量热法测定RE(Et2dtc)3(phen)配合物的比热容

A calculation formula for determining the specific heat capacity of solid compound with an improved RD496-Ⅲ microcalorimeter was derived. The calorimetric constant and precision determined by the Joule effect were （63.901±0.030）μV/mW and 0.3% at 298.15 K, respectively, and the total disequilibrium heat has been measured by the Peltier effect. The specific heat capacities of two standard substances （benchmark benzoic acid and α-Al2O3） were obtained with this microcalorimeter, and the differences between their calculated values and literature values were less than 0.4%. Similarly, the specific heat capacities of thirteen solid complexes, RE（Et2dtc）3（phen） （RE=La, Pr, Nd, Sm-Lu, Et2dtc： diethyldithiocarbamate ion, phen： 1,10-phenanthroline） were gained, and their total deviations were within 1.0%. These values were plotted against the atomic numbers of rare-earth, which presents tripartite effect, suggesting a certain amount of covalent character in the bond of RE^3＋and ligands, according to Nephelauxetic effect of 4f electrons of rare earth ions.     

Design of data acquisition system and algorithm research for omnidirectional gamma-ray positioning equipment

This article introduces the design and performance of the data acquisition system used in an omnidi- rectional gamma-ray positioning system, along with a new method used in this system to obtain the position of radiation sources in a large field. This data acquisition system has various built-in interfaces collecting, in real time, information from the radiation detector, the video camera and the GPS positioning module. Experiments show that the data acquisition system is capable of carrying out the proposed quantitative analysis to derive the position of radioactive sources, which also satisfies the requirements of high stability and reliability.     

火花点火激发均质压燃燃烧过程的模拟研究

本文对火花点火激发均质压燃SICI燃烧过程进行了建模,利用发动机试验进行了模型验证,模型能较好地描述混合气被点燃压燃的过程。通过三维数值模拟与解析,对比了纯均质压燃HCCI燃烧模式和SICI燃烧模式下的燃烧过程,分析了SICI燃烧的特点。结果表明,SICI燃烧过程中存在多阶段着火,燃烧呈现出顺序放热。SICI燃烧热效率高,NO_x排放低,是一种汽油机有潜力的燃烧方式。     

基于Al2O3/Pt纳米晶/HfO2叠层的MOS电容存储效应研究

采用电子束蒸发Pt和后快速热退火的方法,研究了退火条件对Pt纳米晶的生长特性的影响,结果显示Pt纳米晶的密度随退火温度的升高和退火时间的延长均表现出先增大后减小的趋势.在800℃下退火20 s能得到分布均匀的、密度为30×10¹¹ cm^-2的Pt纳米晶.进一步研究了基于Al₂O₃/Pt纳米晶/HfO₂叠层的MOS电容结构的存储效应,表明其在-3—+8 V扫描电压范围下C-V< 关键词： Pt纳米晶 快速热退火 原子层淀积 存储效应     

VaR约束下均值-方差模型在基金资产配置的应用

随着我国开放式基金的迅猛发展以及证券市场的波动，如何识别和控制基金风险这一问题越显重要。VaR模型是一种有效的风险计量和管理工具，本文刻划VaR约束下均值-方差模型及其优化模型，并运用基于VaR约束下的均值——方差模型，定量地分析投资基金的投资组合收益和风险，提出开放式基金最优资产配置，使投资组合收益最大。     

一类带多重核元集在线装箱问题

本文讨论了一类在线变尺寸装箱问题,假定箱子的尺寸可以是不同的.箱子是在线到达的,仅当箱子到达后其尺寸才知道.给定一个带有核元的物品表及其上的核元关系图.我们的目标是要将表中元素装入到达的箱子中,保证任何箱子所装物品不互为核元,即所装物品对应的点所导出的子图是个空图,并使得所用的箱子总长最小.我们证明了该问题是NPHard的,并给出了基于图的点染色、图的团分解和基于背包问题的近似算法,给出了算法的时间复杂度和性能界.     

三重四极杆复合线性离子阱质谱联用技术在农兽药残留检测中的研究进展

三重四极杆复合线性离子阱质谱(QTRAP-MS/MS)联用技术可提供多种扫描模式,在保留良好选择性和灵敏度的同时提高仪器定性检测能力,在农兽药残留检测中具有独特优势。本文综合分析了近五年QTRAP-MS/MS在国内外农兽药残留检测中的应用现状,从QTRAP-MS/MS的结构及原理和检测前处理等方面展开概述,并对其未来发展趋势从前处理技术、微型便携化仪器、与其他仪器联用等方面进行展望,以期为食品安全、农药兽药残留检测提供参考。