增湿活化反应器内喷水脱硫试验研究

本文介绍在热态脱硫试验台上进行的生石灰和消石灰的喷水活化脱硫试验,研究了Ca/S比、饱和温距、入口烟气SO2浓度、烟气速度及水喷嘴雾化风对脱硫效率和钙利用率的影响规律,对两种脱硫剂的脱硫活性进行了比较,并对喷水增湿提高脱硫效率的机理进行了分析。研究表明,喷水增湿使两种脱硫剂的活性都有明显提高,生石灰具有价格优势。     

Brittle-Ductile Transition of Ferroelectric Ceramics Induced by Thermally Activated Dislocation Emission

Thermally activated dislocation emission in high-temperature ferroelectric ceramics is investigated through an assumption of thermal stability and a novel analytical method. The stress intensity factor (SIF) arising from domain switching is evaluated by using a Green's function method, and the critical applied electric field intensity factor (CAEFIF) for brittle fracture at room temperature is obtained. Besides, the lowest temperature for single dislocation emission before brittle fracture is also obtained by constructing an energy balance. The multi-scale analysis of facture toughness of the ferroelectric ceramics at high temperature is carried out. Through the analysis, the CAEFIF for crack extension is recalculated. The results show that the competition and interaction effects between dislocation emission and brittle fracture are very obvious. Besides, the higher critical activation temperature, the more columns of obstacles will be overcome. Additionally, the shielding effect arising from thermally activated dislocations is remarkable, thus, the brittle-ductile transition can promote the fracture toughness of high-temperature ferroelectric ceramics.     

Long Distance Electronic Effects on the Rotational Potential Barriers Around the Caromatic-Cethylenic Bond

A systematic study of the rotational activation free energy around the C_aromatic-C_ethylenic bond of para-substituted styrene systems is carried out in the present work from a quantum chemistry point of view.

Calculations of the rotational potential barriers in the AM1 approach are developed as function of the electron-donor groups localized on the aromatic ring. Based on these calculations and thermodynamical data, we predict changes in the activation free energy barriers due to the long distance electronic effects of the substituents in acetophenones, cinnamaldehydes and benzalketones according to the following equation:

Our results agree the experimental measurements registered up to date and the standard deviations are similar to experimental determinations.     

个人中子剂量气泡探测器研制

中子固体气泡探测器被认为是唯一能够满足国际辐射防护委员会ICRP60要求的个人中子剂量计，它具有从低能中子到高能中子的平坦响应曲线和对γ射线不灵敏的优点.本工作将过热液滴均匀地分布在一种软聚合物中，制成了个人中子气泡剂量计,其灵敏度达到每毫雷姆40个气泡.还介绍了个人中子剂量气泡探测器的原理和制作过程.Neutron solid bubble detector was considered as a unique one for meeting the need of the personal neutron dosimeter recommended by International Committee of radiation protection,ICRP60.It has the flat response for neutron from low energy to high energy,and insensitive for gamma rays. In this work,superheated liquid drops were dispersed into a kind of soft polymer homogeneously.A personal neutron bubble dosimeter has been made,and the sensitivity reached to about 40bubbles/mrem.The principle and the processing procedure of bubble detector were also introduced in this paper.     

模拟核测井工具响应的一种MC方法

描述了模拟双源距中子孔隙度测井工具响应的一种MC方法。在这个专用MC程序中,使用了几种有效方差降低技巧,如:隐吸收、权截断、能量截断、几何分裂和赌、方向偏倚等。针对这种核测井工具,将这些技巧作些改进;通过在程序中分别加上这几种方差降低技巧,对各自运行结果、精度、计算时间的分析和讨论,指出这些技巧的优缺点,亦证明了这些技巧确实有效;同时在某种程度上将此专用程序与通用程序做了比较。     

高能重离子加速器次级中子屏蔽的理论估算

用R.Madey等人提出的由核反应参数计算屏蔽的方法,计算了入射离子单核能为0.6、1.2GeV¹²C束轰击厚Cu靶的次级中子屏蔽.当入射离子束流为1×10¹³ions/s时,其前向和侧向混凝土屏蔽厚度分别为9.8、4.8m(对0.6GeV)和11.5、6.9m(对1.2GeV).     

300#研究堆首炉中央孔道中子通量密度计算

基于MCNP程序对300#研究堆首炉堆芯进行精细建模,通过并行计算方式得到了实验临界棒位下堆芯的有效增殖因数为1.002 29,与临界值之间的相对误差为0.229%,验证了物理模型的正确性。探讨并解决了并行计算的中断与接续问题,提出了体通量计数与点探测器计数应用中的合理化建议,即对大体积空间计数时尽量使用体通量计数。计算值与实验值对比结果表明：两者在3 MW功率水平下热中子通量密度相差4.6％,符合得较好。     

硅量子点发光的激活及其物理模型研究

在真空或惰性气体中制备的硅量子点发光很弱,硅量子点表面被氢较好钝化后的发光也不强.硅量子点表面的硅氧键或硅氮键能破坏这种钝化并在带隙中形成局域电子态,在局域电子态对应的激活中心有很强的发光.可以用这种方式构建发光物质,控制硅量子点表面的键合可获得不同波长的发光.在硅量子点的发光激活处理过程中,退火是很重要的环节.对于硅量子点发光激活的机理,本文给出了相应的物理模型.实验证明,在600和700 nm波长附近观察到了激活硅量子点的受激发光,在1500 nm到1600 nm波长范围观察到了激活硅量子点的较强发光.     

金刚石对顶砧原位电导率测量系统

 在金刚石对顶砧中进行原位高温高压电阻测量时,由于受到绝热层的限制,从而达不到理想的温度条件。采用普通的粉末绝热材料,会给电极的引入造成很大困难,而且不规则的电阻丝使电阻测量很难精确量化。利用溅射镀膜方法,在对顶砧的砧面上镀氧化铝膜作绝热层,溅射的金属钼膜作电极材料,成功地完成了高温高压条件下原位电阻的测量。利用此装置,测量了铁镁硅酸盐(Mg_0.875,Fe_0.125)₂SiO₄在高温高压环境下（31~35 GPa,1 500~3 400 K）的电导率,得到了样品的导电粒子激活能,发现其激活能随着压强的升高而增大,与低压低温（小于15 GPa,低于1 200 K）条件相比,其激活体积和激活能都明显减小。     

Mechanistic investigations in α‐hydroxycarbonyls reduction by BH4‐

BH₄^‐, a well‐known and widely used reducing agent for carbonyl compounds, has been reported to have the ability to participate in dihydrogen bonding, an interaction with applications in catalysis, stereoselectivity and crystal engineering. Specifically, α‐hydroxycarbonyls are activated for reduction by dihydrogen bonding that occurs between BH₄^‐ and hydroxyl group. We explored the effect of the interaction on the mechanism of these reactions by examining their activation parameters. We found that dihydrogen bonding activates α‐hydroxycyclopentanone for reduction with NBu₄BH₄ by lowering the activation enthalpy by 6.6 kcal/mol. While the activation entropy is a significant component of the barrier, the changes resulting from the occurrence of dihydrogen bonding are manifested predominantly in the enthalpy term. Computational studies suggest that, while internal hydrogen bonding is allowed by the flexibility of the carbon backbone, that interaction is outweighed by dihydrogen bonding once BH₄^‐ is present in the system. Experimentally, a red shift of the hydroxyl frequency is observed upon addition of BH₄^‐ to the reaction mixture, suggesting a dihydrogen bonding interaction. The flexibility of the substrate's skeleton or the selectivity of the hydride sites in BH₄^‐ does not account for the lack of directing effect of the dihydrogen bonding. When a substrate with a rigid naphthalene backbone moiety, 2‐hydroxyacenaphthylen‐1(2H)‐one, is reduced, the stereochemical outcome is very similar to the one corresponding to the α‐hydroxycyclopentanone. Copyright © 2012 John Wiley & Sons, Ltd.