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应用商业软件ANSYS CFX计算了等离子体热通量和液态锂流速对自由流动液态锂温度分布的影响。计算结果表明,导向槽中心附近液态锂温度较高,冷却水入口和出口对应位置液态锂温度最低。液态锂出口温度随着等离子体热通量的增大而线性升高,冷却水流速为1.5m·s-1,热通量分别为0.1MW·m-2和1MW·m-2时,液态锂在出口处对应的温度分别为255.3°C和458.6°C。增大液态锂流速,导向槽内液态锂的温度逐渐降低,但温度变化的幅度较小。计算结果对液态锂回路安全稳定运行提供了一定参考。     

大耕深旋耕刀激光冲击强化残余应力研究

研究了激光冲击强化对回转半径为350mm大耕深旋耕刀残余应力的影响,利用ANSYS对旋耕刀进行理论应力分析,发现应力集中在刀柄外弯角处,同时进行了激光冲击强化模拟,得到理论残余应力引入值。利用X射线衍射法对激光冲击强化前后旋耕刀表面进行了残余应力测试。结果表明,ANSYS模拟激光冲击强化引入的残余应力值与试验实测的结果吻合得较好,相比未经处理的旋耕刀,激光冲击强化后刀具表面残余应力明显增大,最大残余压应力达412.25 MPa,增幅达166%,残余压应力的引入可消除旋耕刀工作的应力集中,提高了刀具使用寿命。研究结果为进一步提高和优化大耕深旋耕刀制造工艺提供了新的参考依据。     

COS Activation by Zr~＋ in the Gas Phase：A Case of Two-state Reactivity Process

To elucidate the mechanisms of Zr + reacting with COS,both the quartet and doublet potential energy surfaces (PESs) for reactions of Zr + (4 F,2 D) with COS in the gas phase have been investigated in detail by means of density functional method (B3LYP).To obtain more accurate results,the coupled cluster single-point calculations (CCSD(T)) using B3LYP optimized geometries were performed.For the C-O bond activation,the calculated results indicate that both the quartet and doublet states proceed via an insertion-elimination mechanism.For the C-S bond activation,the quartet reaction has an insertion-elimination mechanism,but the doublet reaction is a direct abstraction of the sulfur atom by Zr +.The C-S bond activation is found to be energetically more favorable than the C-O bond activation.It is found that the reaction of the 4 F gound state of Zr + to yield ZrO + is spin-forbidden (Zr + (4 F) + COS (1 Σ) → ZrO + (2) + CS (1 Σ)) and the crossing points were approximately determined.All the results have been compared with the existing experimental and theoretical data.     

3,4-二氨基苯基苯甲酮在基质辅助激光解析离子化质谱分析磷脂中的应用

考察了3,4-二氨基苯基苯甲酮(DABP)作为基质辅助激光解吸离子化飞行时间质谱(MALDI-TOF-MS)新型基质分析磷脂的能力.与传统基质2,4,6-三羟基苯乙酮(THAP)、2,5-二羟基苯甲酸(DHB)、α-氰基-4-羟基肉桂酸(CHCA)相比,用优化后的DABP基质溶液体系McOH-H2O-HCI(80:20...     

Co-MCM-41催化H2O2氧化4-甲基吡啶生成4-吡啶甲酸的反应条件及机理

研究了乙酸溶剂中无引发剂条件下,Co掺杂MCM-41催化过氧化氢（30%）氧化4-甲基吡啶的反应,催化剂表现出高底物转化率和产物吡啶甲酸选择性以及良好的再生性。 探讨了不同溶剂、反应时间、反应温度、催化剂用量等对H2O2氧化4-甲基吡啶反应的影响,确定较优反应条件为m（4-甲基吡啶)∶m（催化剂)=10∶1,V（4-甲基吡啶)∶V（冰醋酸)=1∶10,温度363 K,时间6 h。 该条件下4-甲基吡啶的转化率为96.5%,4-吡啶甲酸的选择性为91.4%。 探讨了可能的反应机理。     

脱氧核糖核酸的毛细管无胶筛分电泳迁移规律研究

本文研究了不同因素对脱氧核糖核酸(DNA)毛细管电泳迁移行为的影响.采用毛细管无胶筛分电泳法,对不同片段长度DNA进行分离检测,考察DNA片度长度、电场强度、聚合物浓度及分子量等因素对DNA迁移行为的影响.实验结果显示,DNA迁移时间随其长度的增加而延长;电场强度越高,DNA迁移时间越短,分离效果变差;DNA在高浓度聚...     

Comparison of Different Cartridges of Solid Phase Extraction for Determination of Polyphenols in Tobacco by UPLC/MS/MS and Multivariate Analysis

The comparison of solid phase extraction(SPE) for the preconcentration and isolation of polyphenols in tobacco samples was carried out by ultra-high performance liquid chromatography/tandem mass spectrometry (UPLC/MS/MS) and multivariate analysis.Several adsorbing materials of SPE(C18,NH2,SAX and OASIS) were investigated.It was found that the C18 and OASIS cartridges can not only speed up the purification process,but also simplify the SPE operation.A UPLC/MS/MS was used for the determination of polyphenols ...     

PAR-1拮抗剂E5555的全合成

以3-氟邻苯二酚和邻叔丁基苯酚为原料,经14步反应完全PAR-1拮抗剂--1-(3-叔丁基-5-吗啉4-甲氧基苯基)-2-(5,6-二乙氧基.7-氟-1-亚胺二氢异吲哚)乙酮氢溴酸盐(E5555)的全合成,总产率27.2%,其结构经<'1>H NMR确证.     

Multipliers,covers, and stem extensions for Lie superalgebras

Suppose that the underlying field is of characteristic different from 2 and 3. We first prove that the so-called stem deformations of a free presentation of a finite-dimensional Lie superalgebra L exhaust all the maximal stem extensions of L; up to equivalence of extensions. Then we prove that multipliers and covers always exist for a Lie superalgebra and they are unique up to superalgebra isomorphisms. Finally, we describe the multipliers, covers, and maximal stem extensions of Heisenberg superalgebras and model filiform Lie superalgebras.     

理论研究激光强度对H2+分子高次谐波产生的影响

本文通过求解非波恩-奥本海默近似条件下的一维含时薛定谔方程来研究脉冲强度对H₂⁺分子高次谐波的影响.由于干涉相消,在啁啾激光场的条件下在谐波谱中出现了干涉最小值.我们用全量子方法计算的时频分布图分析了分子高次谐波产生中的微观机制.此外,数值计算结果显示随着脉冲强度的增加电子的有质动力势随之增加,同时干涉最小值的位置移向谐波的高阶部分.