Spectroscopic properties of Fe ions at tetragonal sites—Crystal field effects and microscopic modeling of spin Hamiltonian parameters for Fe (S=2) ions in K2FeF4 and K2ZnF4

Magnetic and spectroscopic properties of the planar antiferromagnet K₂FeF₄ are determined by the Fe²⁺ ions at tetragonal sites. The two-dimensional easy-plane anisotropy exhibited by K₂FeF₄ is due to the zero field splitting (ZFS) terms arising from the orbital singlet ground state of Fe²⁺ ions with the spin S=2. To provide insight into the single-ion magnetic anisotropy of K₂FeF₄, the crystal field theory and the microscopic spin Hamiltonian (MSH) approach based on the tensor method is adopted. Survey of available experimental data on the crystal field energy levels and free-ion parameters for Fe²⁺ ions in K₂FeF₄ and related compounds is carried out to provide input for microscopic modeling of the ZFS parameters and the Zeeman electronic ones. The ZFS parameters are expressed in the extended Stevens notation and include contributions up to the fourth-order using as perturbation the spin-orbit and electronic spin-spin couplings within the tetragonal crystal field states of the ground ⁵D multiplet. Modeling of the ZFS parameters and the Zeeman electronic ones is carried out. Variation of these parameters is studied taking into account reasonable ranges of the microscopic ones, i.e. the spin-orbit and spin-spin coupling constants, and the energy level splittings, suitable for Fe²⁺ ions in K₂FeF₄ and Fe²⁺:K₂ZnF₄. Conversions between the ZFS parameters in the extended Stevens notation and the conventional ones are considered to enable comparison with the data of others. Comparative analysis of the MSH formulas derived earlier and our more complete ones indicates the importance of terms omitted earlier as well as the fourth-order ZFS parameters and the spin-spin coupling related contributions. The results may be useful also for Fe²⁺ ions at axial symmetry sites in related systems, i.e. Fe:K₂MnF₄, Rb₂Co_1−xFe_xF₄, Fe²⁺:Rb₂CrCl₄, and Fe²⁺:Rb₂ZnCl₄.     

提高硅光电探测器树脂封装可靠性研究

树脂封装能缩小器件尺寸、减轻重量、降低成本、促进小型化。但它的可靠性,特别足抗潮湿性差。本文通过抗潮湿性能分析,比较了几种树脂封装,发现用F S203 C十G N522封装可提高其可靠性。     

Reactive incompatibility of DTBP mixed with two acid solutions

Organic peroxides are commonly employed as an initiator for polymerization, a source of free radicals, a hardener, and a linking agent. Due to its relatively weak oxygen-oxygen bond, di-tert butyl peroxide (DTBP) has been categorized as flammable type or Class III by the National Fire Protection Association (NFPA). The transport of dangerous goods (TDG) has published a warning against DTBP that it could potentially induce violent heat, explosion, fire and self-ignition under certain circumstances. DTBP has been recommended as an international standard sample for estimating the performance of several calorimeters, such as glass tube tests, differential scanning calorimetry (DSC), and vent sizing package 2 (VSP2). In this study, we measured the precise temperature changes and heat flow with the above-mentioned testing instruments. However, some runaway incidents caused by DTBP have demonstrated the reaction temperature could be as low as ambient temperature. The reactivity and the hazardous incompatibility with sulfuric acid (H₂SO₄) and hydrochloric acid (HCl) of DTBP have not been evident, and the runaway hazards involved in different processing conditions were clarified in this study by implementing the two calorimeters. Acid-catalyzed characteristics and reaction hazards of DTBP could be acquired, such as heat of decomposition (ΔH _d) and exothermic onset temperature (T ₀).     

Quantum chemical investigation of structural and thermodynamic peculiarities of the formation of cucurbit[<Emphasis Type="Italic">n</Emphasis>]urils

Calculations of the structures of cucurbit[n]urils (n = 5–8) and estimations of thermodynamic parameters of their formation are carried out using a high-performance program package PRIRODA at the density functional theory level using the PBE functional and DZ basis set optimized for this functional. Based on the calculated Gibbs free energies of the reaction of CB[n] formation, it is concluded that the CB[6] homolog slightly dominates among the other products of the synthesis.     

系统级封装应用中时谐Maxwell方程大规模计算的求解算法:现状与挑战

系统级封装（SiP）是当前电子学系统设计的主流技术途径,数值模拟是进行系统级封装（SiP）设计的主要手段。由于系统级封装应用特有的复杂性,现有的求解时谐Maxwell方程离散系统的算法面临很大的挑战,成为制约该类应用大规模数值模拟效率的瓶颈。本文综述系统级封装应用时谐Maxwell方程解法器求解算法,针对典型实际模型,评估现有算法的现状和面临的挑战,分析应用特征对算法计算能力的影响,并在现有算法的基础上提出一种可行的预条件算法策略。     

气相色谱法测定高分子食品包装材料中抗氧化剂的残留量

建立了气相色谱测定高分子食品包装材料中抗氧化剂丁基羟基茴香醚(BHA)、二丁基羟基甲苯(BHT)和特丁基对苯二酚(TBHQ)残留量的分析方法。用环己烷超声萃取高分子食品包装材料样品,考察了萃取时间、温度对抗氧化剂萃取量的影响。萃取液经气相色谱柱HP-50+毛细管柱(30 m×0.53 mm×1 μm)分离,电子捕获检测器(ECD)检测,外标法定量。结果表明: 在抗氧化剂添加量为3.00～10.0 mg/kg范围内,BHT、BHA、TBHQ在高分子食品包装材料中的平均添加回收率分别为88%～93%、92%～101%和83%～97%,相对标准偏差(RSD, n=5)分别为2.01%～2.89%、2.11%～3.19%和2.99%～4.02%;检出限(信噪比为3)分别为0.5、0.5和0.8 mg/kg。对实际高分子食品包装材料样品的检测结果表明3种抗氧化剂在不同材质中均有检出: 塑料材料中抗氧化剂的含量较少,仅有BHT、BHA被检出,含量为6.3～7.8 mg/kg;橡胶材料中3种抗氧化剂均被检出,含量为9.3～28.4 mg/kg。该方法准确、灵敏、重现性好,适用于高分子食品包装材料中抗氧化剂残留量的检测。     

散弹噪声极限稳定度优于1×10-13τ-1/2的铷频标物理系统

近年来,铷原子频标研究取得长足进展,频率稳定度达到10^-13τ^-1/2量级.为进一步改善铷频标稳定度性能,本文设计了一种高信噪比物理系统.物理系统中的腔泡组件采用微波场磁力线与量子化轴方向高度平行的开槽管式微波腔,滤光泡和吸收泡独立控温.抽运光源采用了光学滤光和同位素滤光双重滤光方案.本文实测了背景光电流I₀和鉴频斜率K_d,结果分别为95 μA和7.7 nA/Hz,在此基础上计算物理系统的散弹噪声极限稳定度为7.5×10^-14τ^-1/2.研究结果表明,只要锁频环路的电子学噪声得到有效控制,铷频标的频率稳定度突破1×10^-13τ^-1/2,进入10^-14τ^-1/2量级是完全可能的.     

Measuring the Stability of Results From Supervised Statistical Learning

Stability is a major requirement to draw reliable conclusions when interpreting results from supervised statistical learning. In this article, we present a general framework for assessing and comparing the stability of results, which can be used in real-world statistical learning applications as well as in simulation and benchmark studies. We use the framework to show that stability is a property of both the algorithm and the data-generating process. In particular, we demonstrate that unstable algorithms (such as recursive partitioning) can produce stable results when the functional form of the relationship between the predictors and the response matches the algorithm. Typical uses of the framework in practical data analysis would be to compare the stability of results generated by different candidate algorithms for a dataset at hand or to assess the stability of algorithms in a benchmark study. Code to perform the stability analyses is provided in the form of an R package. Supplementary material for this article is available online.     

基于Mie散射理论的白光发光二极管荧光粉散射特性研究

基于Mie散射理论,对大功率发光二极管封装中荧光粉的光激发、吸收、散射等作用进行数值模拟,仿真计算在不同白光色温时前后向散射光的强度比例,研究了荧光粉的颗粒大小对白光发光二极管最大光通量的影响.对保型荧光粉涂覆结构中不同直径荧光粉颗粒和不同色温时的光效进行了分析,还分析了同样色温下不同荧光粉颗粒直径、涂层的厚度对白光发光二极管出光的空间色温分布均匀性的影响.研究中所采用的器件激发光谱和发射光谱都为材料的实测光谱,而并非假设的单一光谱.研究表明:在采用保型荧光粉涂覆结构的前提下,当荧光粉颖粒直径为0.5μm时能使发光二极管光通量达到最大;荧光粉颗粒越小,发光二极管空间色温分布均匀性越好;对给定的封装结构,荧光粉涂层厚度为0.8 mm时空间色温分布均匀性最佳.     

LED的COB封装热仿真设计

通过对COB封装中常用的陶瓷基板和金属基板这两类不同的基板材料进行有限元热仿真模拟,获得各自芯片到基板的仿真热阻,再使用红外热成像仪得到两种基板各自的表面温度分布情况并计算出实际热阻。仿真热阻与实际热阻的一致性表明了所采用的仿真计算方法的可用性。利用有限元仿真对COB封装的热管理方案进行了优化分析。研究表明:相对于金属基板,陶瓷基板由于无绝缘层这一散热瓶颈,其芯片到基板的热阻值约为金属基板封装方案的1/2;而且陶瓷基板有着更大的热管理优化空间,能更好地满足大功率LED封装的散热需要。