Insights into the intrinsic interaction between series of C1 molecules and surface of NiO oxygen carriers involved in chemical looping processes

Understanding and modulating the interaction between various reactive molecules and oxygen carriers are the key issue to achieve process intensification of chemical looping technology. C1 chemical molecules play an important role in many reactions involved with chemical looping processes. However, up to now, there is still a lack of systematic and in-depth understanding of the adsorption mechanism of C1 molecules on the surface of oxygen carriers (OCs). In this work, the intrinsic interaction between a series of C1 molecules composed of CH₄, CO, CO₂, CH₃OH, HCHO and HCOOH and surface of NiO OCs in the chemical looping process have been studied using density functional theory calculations. Various adsorption configurations of C1 molecules and also different adsorption sites of NiO have been considered. The structural features of stable configuration of C1 molecules on the surface of NiO OCs have been obtained. Further, the interacted sites, types and strengths of C1 molecules on the surface of NiO have been directly pictured by the independent gradient model methods. Also, the nature of the interaction between C1 molecule and NiO surface has been investigated with the aid of energy decomposition analysis from a quantitative view.     

FeS2@TiO2 nanorods as high-performance anode for sodium ion battery

Sodium-ion battery (SIB) is an ideal device that could replace lithium-ion battery (LIB) in grid-scale energy storage system for power because of the low cost and rich reserve of raw material. The key challenge lies in developing electrode materials enabling reversible Na⁺ insertion/desertion and fast reaction kinetics. Herein, a core-shell structure, FeS₂ nanoparticles encapsulated in biphase TiO₂ shell (FeS₂@TiO₂), is developed towards the improvement of sodium storage. The diphase TiO₂ coating supplies abundant anatase/rutile interface and oxygen vacancies which will enhance the charge transfer, and avoid severe volume variation of FeS₂ caused by the Na⁺ insertion. The FeS₂ core will deliver high theoretical capacity through its conversion reaction mechanism. Consequently, the FeS₂@TiO₂ nanorods display notable performance as anode for SIBs including long-term cycling performance (637.8 mA·h·g^-1 at 0.2 A·g^-1 after 300 cycles, 374.9 mA·h·g^-1 at 5.0 A·g^-1 after 600 cycles) and outstanding rate capability (222.2 mA·h·g^-1 at 10 A·g^-1). Furthermore, the synthesized FeS₂@TiO₂ demonstrates significant pseudocapacitive behavior which accounts for 90.7% of the Na⁺ storage, and efficiently boosts the rate capability. This work provides a new pathway to fabricate anode material with an optimized structure and crystal phase for SIBs.     

Surface morphology and nodule formation mechanism of cellulose acetate membranes by atomic force microscopy

By the use of atomic force microscopy (AFM), formation mechanism of nodular structure in cellulose acetate membranes was systematically investigated. Elementary factors affecting the nodule formation were delineated on the basis of both kinetic and thermodynamic considerations. It was shown that (1) the exact nature of nodular structure is thermodynamic equilibrium glassy state; nodular structure will vanish in the rubbery state; (2) the thermodynamic factor affecting nodule formation is the membrane formation temperature; with the membrane formation temperature decreasing, more chain segments are able to form nodular structures; (3) nodule formation is dependent on the segment rearrangement; variation of the solvent environment is the major kinetic factor affecting the segment rearrangement and nodule formation. © 2003 Wiley Periodicals, Inc. J Appl Polym Sci 88: 1328–1335, 2003     

基于CaO引导的甲烷蒸汽重整化学链燃烧制氢系统

为在重整气中得到高纯H_2和降低尾气CO_2分离成本,建立了基于CaO引导的甲烷蒸汽重整化学链燃烧制氢系统,该系统在重整反应器中加入CaO吸收剂,用以吸收重整器内的CO_2,提高重整气中H_2浓度,形成的CaCO_3固体在煅烧器中受热分解重新生成CaO。利用Aspen Plus进行了过程模拟及热力学分析,并研究主要参数对系统性能的影响,得到优化的操作条件为:CaO循环量/CH_4比为0.5,CH_4(燃料)/CH_4比为0.35,NiO循环量/CH_4比为1.4。CaO循环量/CH_4比从0变化到0.5时,重整气中H_2浓度从0.60增长到0.99;CH_4(燃料)/CH_4比在0.25~0.45区间变化时,重整气中H_2浓度从0.86提高到0.99,产气量增加;NiO循环量/CH_4比在1~1.6区间变化时,重整气中H_2浓度从0.88增长到0.99,系统有效能效率变化较小。     

离子色谱法测定配煤、焦炭和焦油中的氯含量

研究了用带电导检测器的离子色谱对配煤、焦炭和焦油中的Cl- 进行测定的方法。在YSA型8126A-4# 阴离子分离柱上用3.5mmol/LNa2CO3、5.3mmol/LNaHCO3做淋洗液对Cl-进行测定,方法简便快速。Cl-的检出限为2×10-6。该法也适用于F-、NO2-、NO3-、SO42-等的测定。     

浅谈P3软件在电力基建工程中的应用

P3软件是一套体现了现代化项目管理理念的项目管理工具，在建设管理上推广应用P3工程管理软件，可以提高各参建单位的工作效率、加快工程信息交流、数据共享和工程进度管理水平，在管理上尽快与国际接轨，本文就P3软件在电力基建工程中的应用做以简单介绍。     

Three schemes of remote information concentration based on ancilla-free phase-covariant telecloning

In this paper, remote information concentration is investigated which is the reverse process of the $1\rightarrow 3$ optimal asymmetric economical phase-covariant telecloning (OAEPCT). The OAEPCT is different from the reverse process of optimal universal telecloning. It is shown that the quantum information via $1\rightarrow 3$ OAEPCT procedure can be remotely concentrated back to a single qubit with a certain probability via several quantum channels. In these schemes, we adopt Bell measurement to measure the joint systems and use projected measurement and positive operator-valued measure to recover the original quantum state. The results shows non-maximally entangled quantum resource can be applied to information concentration.     

一种关于目标罚参数的精确罚函数法

罚函数法是一种将约束优化问题转化为无约束问题的重要方法.对于一般的约束优化问题,通过加入新参数,给出了一种改进的精确罚函数和这种罚函数的精确罚定理证明,提出了求解这种罚函数的算法.实验表明该算法是有效的.     

环形橡胶径向刚度特性仿真分析

利用ANSYS软件建立了环形橡胶的有限元参数化模型,将对模型仿真所得结果与已有数据进行对比,验证了仿真模型的正确性,实现了环形橡胶径向刚度的快速计算.在此基础上,分析了内外圆柱面半径与轴向长度对环形橡胶简化径向刚度值的影响,研究了环形橡胶的径向刚度特性,确立了在环形橡胶实际设计中需要考虑的要点,为环形橡胶的设计提供了依据.