Nucleophilic Activation of Sulfur Hexafluoride by N-Heterocyclic Carbenes and N-Heterocyclic Olefins: A Computational Study

Sulfur hexafluoride (SF₆) is considered as a potent greenhouse gas, whose effective degradation is challenging. Here we report a computational study on the nucleophilic activation of sulfur hexafluoride by N-heterocyclic carbenes and N-heterocyclic olefins. The result shows that the activation of SF₆ is both thermodynamically and kinetically favorable at mild condition using NHOs with fluoro-substituted azolium and sulfur pentafluoride anion being formed. The Gibbs free energy barrier during the activation of SF₆ has a linear relationship with the energy of HOMO of substrates, which could be a guideline for applying those compounds that feature higher energy in HOMO to activate SF₆ in high efficiency.     

基于Web的图书馆管理系统访问控制策略

针对基于Web的图书馆管理系统资源访问控制的动态性问题，提出了一种基于角色的访问控制策略描述方案．通过对基于Web的图书馆管理系统访问控制管理影响因素和访问控制需求的分析，结合NIST基于角色的访问控制统一模型标准，构造了一种基于角色的访问控制元模型．并在这一元模型的基础上，提出了一种紧凑的基于角色的访问控制XML策略描述语言框架．结果表明该访问控制策略描述语言框架适合表述动态环境下对图书馆资源的访问策略，提高了基于Web的图书馆管理系统资源访问的安全性．     

A biocatalytic route to enantioenriched, sulfanyl aldol products

The aldol products derived from sulfur- or selenium containing acceptors were prepared by kinetic resolution in the presence of antibody 84G3 with enantiomeric excesses ranging from 56 to 70%. Much higher level of enantioselectivity was obtained (enantiomeric excesses all superior to 96%) for sulfanyl aldol products derived from thiomethoxyacetone with three different acceptors.     

CID-ICP-AES检测煤中不同形态的硫

研究了CID-ICP-AES检测煤中硫酸盐和硫铁矿形态硫的方法。较现有国标方法快速、简便，常见元素不干扰，加标回收率在98．5％-103．0％之间，10次测定的RSD在0．76％-1．59％之间。     

Determination of the boiling point distribution of sulfur compounds in light cycle oil using GC with a flame photometric detector and pyrolyzer

A method has been developed to determine the boiling point distribution of sulfur compounds in light cycle oils (LCO'S). The method chosen for this analysis was GC with a flame photometric detector (FPD) and pyrolyzer. Tests were carried out to evaluate the recovery efficiency, repeatability, and accuracy of the method. Repeatabilities within 2% were obtained. The recovery of benzothiophenes and dibenzothiophenes was close to 100%; this was important because these are the major sulfur components in LCO's. No hydrocarbon or solvent interferences were observed with the use of the pyrolyzer, even for a 95% solvent level. Comparison with results from other techniques showed that the method accurately determined the levels of sulfur compounds in the LCO boiling point range.     

Methane activation on Ni(1 1 1): Effects of poisons and step defects

We have, theoretically and experimentally, investigated the dissociation of methane on the terraces and steps of a Ni(1 1 1) surface. Using Density Functional Theory (DFT) total energy calculations combined with Ultra High Vacuum (UHV) experiments, we find that the steps exhibit a higher activity than the terraces. We have, furthermore, investigated how carbon and sulfur present on the surface will deactivate the steps, leaving only the terraces active. We find the intrinsic sticking probabilities of methane on the steps and terraces at 500 K to be 2.8 × 10⁻⁷ for the steps and 2.1 × 10⁻⁹ for the terraces, in complete agreement with our calculated difference in activation energy of 17 kJ/mol.     

IPv4/IPv6翻译网关的研究

In this paper, a model of translation gateway is proposed. The communications between IPv4 network and IPv6 network are realized by using the Microsoft intermediate driver technology in environment of Windows 2000.     

CuO—ZnO／Al2O3—TiO2催化剂中TiO2的结构和电子效应

采用XPS,XRD,TPR,TPD和指标反应等方法研究了TiO_2在负载型CuO-ZnO/Al_2O_3-TiO_2催化剂中所起的作用.发现TiO_2起双重作用,即结构效应和电子效应,TiO_2的结构效应主要表现为它改善了CuO在载体上的分布.TiO_2的电子效应表现为它对Cu~0具有吸电子的作用,从而削弱了Cu和S之间的吸附力,使S容易脱除.另外,部分还原形成的Ti~(3+)具有促进CuS中的Cu~(2+)还原为Cu~0的能力,TiO_2的上述效应的综合结果使催化剂的抗硫中毒性能大大增强.     

用碘酸钾滴定法标定二氧化硫标准溶液

用KIO3滴定法标定SO2标准溶液,RSD≈0.10%,标定结果与标准法结果无显著性差异,相对误差<±0.3%。     

钙钛矿型CO氧化催化剂耐SO2中毒性质的研究

钙钛矿型ＣＯ氧化催化剂耐ＳＯ２中毒性质的研究马春曦王宝辉（大庆石油学院石油化工系安达１５１４００）关键词钙钛矿型催化剂一氧化碳氧化硫中毒近年来，人们对钙钛矿型复合物ＣＯ氧化催化剂作了大量研究，证明其具有很高的ＣＯ氧化活性［１－３］，并开始尝试应用于汽...