7,10,12顶点Fe(Ⅱ)碳硼烷夹心配合物NLO性质的DFT研究

采用密度泛函理论(DFT)CAM-B3LYP方法对系列7,10,12顶点Fe(Ⅱ)碳硼烷与1,2,4,5-Me4C6H2(dur1),1,2,3,4-Me4C5H(dur2)形成的夹心配合物的非线性光学(NLO)性质进行了计算分析.结果表明,Fe(Ⅱ)碳硼烷的顶点数和硝基的取代位置影响分子的几何构型,从而影响分子的NLO性质;Fe(Ⅱ)碳硼烷夹心配合物的偶极矩与极化率随碳硼烷的顶点数增加而增大;10顶点Fe(Ⅱ)碳硼烷分子的前线分子轨道能级差较小,其第一超极化率βtot值大于12及7顶点Fe(Ⅱ)碳硼烷分子;硝基与Fe(Ⅱ)处于对位时,其βtot值大于未取代分子;硝基与Fe(Ⅱ)处于邻位时,βtot值较未取代分子小;在此类Fe(Ⅱ)碳硼烷夹心配合物中,碳硼烷既可以作电子给体,也可以作电子受体.     

空气介质阻挡放电不同放电模式的光谱特性

采用光谱方法,研究了空气介质阻挡放电中流光向类辉光转变时电子能量的变化。利用氮分子第二正带系(C3Π_u→B3Π_g)的发射谱线,测量了氮分子(C3Π_u)的振动温度。通过考察氮分子离子391.4 nm谱线强度与氮分子337.1 nm谱线强度之比,研究了电子平均能量的变化。结果表明,流光向类辉光转变时,氮分子(C3Π_u)的振动温度激增,氮分子离子391.4 nm相对谱线强度突增,表明类辉光放电模式中电子能量比流光放电模式中电子能量高很多。实验还发现,气隙间距不同,这两种放电模式转变所对应的转变气压不同,但转变气压与气隙间距的乘积值保持不变。     

带投资约束且p不确定的推广p-中位问题

p-中位问题是设施选址中的一个经典模型,在交通、物流等领域有着广泛应用．在经典p-中位问题的基础上提出一种p不确定的推广p-中位问题,并且加上总投资约束,使得此推广模型更加实用．针对此推广模型,提出三种启发式算法：简单启发式算法、变邻域搜索算法和改进的遗传算法．数值实验结果表明变邻域搜索算法和改进的遗传算法在求解此推广模型时是有效的．     

Hopf bifurcation control for a coupled nonlinear relative rotation system with time-delay feedbacks

This paper investigates the Hopf bifurcations resulting from time delay in a coupled relative-rotation system with time- delay feedbacks. Firstly, considering external excitation, the dynamical equation of relative rotation nonlinear dynamical system with primary resonance and 1：1 internal resonance under time-delay feedbacks is deduced. Secondly, the averaging equation is obtained by the multiple scales method. The periodic solution in a closed form is presented by a perturbation approach. At last, numerical simulations confirm that time-delay theoretical analyses have influence on the Hopf bifurcation point and the stability of periodic solution.     

“素养+知识”视野下的化学教材习题比较研究——以“硫及其化合物”为例

基于布卢姆教育目标分类学理论,并以化学学科核心素养及其水平划分为依据,从核心素养水平、知识和认知等3个维度对高中化学不同版本教材“硫及其化合物”的课后习题进行统计分析比较。结果表明,在核心素养上,3版教材主要在核心素养的水平1和水平2上设计习题,突出“宏观辨识与微观探析”;在知识维度上更侧重“程序性知识”的考查;在认知维度上,3版教材聚焦于“理解”“运用”和“分析”层次,但是各有侧重。据此提出教材习题使用建议。     

p-i-nInP/In_(0.53)Ga_(0.47)As/InP探测器结构优化

利用半导体仿真工具Silvaco对p-i-n InP/In_(0.53)Ga_(0.47)As/InP近红外光探测器进行优化仿真.参考实际器件对红外探测器进行建模,并将其暗电流、光谱响应仿真结果与实验结果进行拟合,保证仿真结果的有效性.以减小探测器的暗电流为目的,优化其结构.针对探测器吸收层厚度和吸收层掺杂浓度对暗电流、光响应的影响进行研究,发现当吸收层厚度大于0.3μm后,暗电流不再上升,但光响应随着吸收层厚度的增加而增大;当吸收层掺杂浓度不断上升时,器件暗电流不断降低,当掺杂浓度上升到2×1017/cm3时,暗电流达到最低值.本文还研究了p-i-n型探测器的瞬态响应,探究了响应速度与反偏电压之间的关系,发现提高反偏电压能减小探测器响应时间.     

The setereoselective preparation ofβ-keto esters using baker's yeast in the presence of rice wine koji

By the addition of rice wine koji,enhancement of the reactivity was observed for the baker's yeast reduction ofβ-keto esters into (S)-β-hydroxy esters with high enantiomeric purity (73-98%).     

Synthesis of aliphatic amidediol and used as a novel mixed plasticizer for thermoplastic starch

In this paper,aliphatic amidediol was synthesized and mixed with glycerol used as a plasticizer for preparing thermoplastic starch（AGPTPS）.The yield of aliphatic amidediol was 91%.FF-IR expressed that the mixture of aliphatic amidediol and glycerol formed stronger and stable hydrogen bond with starch molecules compared to the native cornstarch.By scanning electron microscope（SEM）native cornstarch granules were proved to transfer to a homogeneous continuous system.After being stored for a period time at room temperature,the mechanical properties of AGPTPS were also studied.As a mixed plasticizer,aliphatic amidediol and glycerol would be practical to extend TPS application scopes.