The Second Law of Thermodynamic in Quantum System

The second law of thermodynamics is one of the most fundamental and for-reaching laws of physics. It teaches us that when a closed system undergoes a thermodynamic process the entropy of the system never decreases; it increases, or at least remains constant. If the entropy increases the thermodynamic process is irreversible, otherwise it is reversible. Only ideal thermal process is reversible. In classical world a great number of facts have proved the second law is true. But in quantum world since the quantum coherence and correlations exist we are not sure the second law is still true, at least in principle. This is because that： 1. on the microscopic level the irreversibility is conflict with the reversibility of all fundamental physical laws ; 2. there are not enough evidences to show it is true in quantum world.     

Reaction kinetics of stover liquefaction in recycled stover polyol

The purpose of this research was to study the kinetics of liquefaction of crop residues. The liquefaction of corn stover in the presence of ethylene glycol and ethylene carbonate using sulfuric acid as a catalyst was studied. It was found that the liquefaction yield was a function of ratio of solvent to corn stover, temperature, residence time, and amount of catalyst. Liquefaction of corn stover was conducted over a range of conditions encompassing residence times of 0–2.5 h, temperatures of 150–170°C, sulfuric acid concentrations of 2–4% (w/w), and liquefaction reagent/corn stover ratio of 1–3. The liquefaction rate constants for individual sets of conditions were examined using a first-order reaction model. Rate constant increased with the increasing of liquefaction temperature, catalyst content, and liquefaction reagent/corn stover ratio. Reuse of liquefied biomass as liquefying agent was also evaluated. When using recycled liquefied biomass instead of fresh liquefaction reagent, the conversion is reduced. It appeared that 82% of liquefaction yield was achieved after two times of reuse.     

关于无风险资产不存在时资产组合选择的研究

以往关于资产组合选择的研究大多假设市场上存在无风险资产,但无风险资产实际上是不存在的.当不存在无风险资产时,假设投资者的效用定义在消费上,消费一直是投资者财富的一个固定比例,投资者的最优资产组合由两部分组成:短视的资产组合和对冲组合.假设只有股票和债券两种风险资产,当股票和债券的风险具有负的相关性时,投资者现在会消费更多,同时也会在股票上投资更多;两者正相关时,投资者无法降低风险,会减持股票并降低当前消费;两者不相关时,投资者持有的股票权重和存在无风险资产时一样.最后,还推导出了多种资产情况下最优消费和资产组合的解析表达式.     

艾滋病防治资源投入的效果分析

基于GOALS模型的基本思想,建立了效果分析模型,并针对两种不同的资金分配方案,模拟了两种方案对2006—2010年某地艾滋病流行的影响,并对模拟结果进行了分析.     

拓扑线性空间中的Drop定理和Phelps引理以及Ekeland变分原理

将Phelps引理,Ekland变分原理,Pareto有效性定理推广到拓扑线性空间,同时证明了这三个定理与郑喜印证明的拓扑线性空间中的Drop定理彼此等价.     

PbTe(001)表面原子几何结构和电子结构的第一性原理计算

用第一性原理的密度泛函理论计算了PbTe（001）表面的几何结构和电子结构.计算结果表明：PbTe（001）表面不发生重构，但表面几层原子表现出明显的振荡弛豫现象，其中第一、第二层间距减小4.5%，第二、第三层间距增加2.0%，并且表面层原子出现褶皱.表面带隙在X 点，带隙变宽，在基本带隙中不引入新的表面态，而导带底和价带顶附近等多处出现新的表 面共振态；弛豫后费米面处态密度很低，所以表面结构很稳定. 关键词： 密度泛函理论 表面几何结构 表面电子结构 PbTe     

Fe-ZSM-5杂原子分子筛的合成与表征

采用静态水热法分别以正丁胺、四丙基溴化铵为模板剂合成ZSM-5分子筛及Fe-ZSM-5杂原子分子筛；利用XRD与FT-IR对其结构进行表征；考察了Mo改性后分子筛催化剂上甲烷脱氢芳构化的反应性能。结果表明，Fe部分进入了分子筛的骨架，导致分子筛的结晶度及表面酸强度的下降，使Mo／Fe-ZSM-5催化剂的反应性能较Mo／HZSM-5显著下降。     

Synthesis and characterization of new bis(1-aryliminomethylenylnaphthalen-2-oxy)nickel complexes and their catalytic behavior for vinyl polymerization of norbornene

The synthesized 1-aryliminomethylenylnaphthalen-2-ol derivatives reacted with nickel chloride to form bis(1-aryliminomethylenylnaphthalen-2-oxy)nickel complexes. All resultant compounds were structurally characterized by elemental analyses, IR and H NMR, and the structures of the formed complexes were elucidated by X-ray crystal structure analysis. The complexes show high catalytic activities for the vinyl polymerization of norbornene in the presence of methylaluminoxane. The catalytic activity variations have been followed by gas chromatography through monitoring the conversion of norbornene.     

爆破拆除冷却塔倾倒过程的研究

从理论上研究了冷却塔在倾倒过程中，转角与时间ｔ之间的关系。对于支撑部分保存完整的冷却塔，计算结果与实测结果基本吻合，相对误差小于１０％。实际倒塌长度与理论倒塌长度之比为０．９８，实际倒塌中心线与理论倒塌中心线左右偏差３．１８，倒塌初始时刻冷却塔未下坐，当ｔ＞０．６ｓ之后，冷却塔开始下坐，下坐高度与倾倒时间成正比。最后，还分析了冷却塔在倾倒过程中的前冲和后坐问题。     

Study on deactivation and regeneration of Pd/Al2O3 catalyst in hydrogen peroxide production by the anthraquinone process

Deactivated palladium catalysts in the hydrogenation of anthraquinione were regenerated with ethanol, nitric acid, hydrogen peroxide, boiling water and steam, respectively. The deactivated and regenerated catalysts were characterized by XPS, ICP, TG, FTIR, TPD, XRD, etc., and studied in the hydrogenation of anthraquinone. The results showed that the main cause of catalyst deactivation is the coverage of the active component by deposits. The treatments by hydrogen peroxide and boiling water can effectively regenerate the deactivated catalysts. This revised version was published online in August 2006 with corrections to the Cover Date.