Describing metal surfaces and nanostructures with orbital-free density functional theory

Orbital-free density functional theory (OF-DFT) can be made to scale linearly with sample size, allowing thousands of atoms to be treated explicitly with quantum mechanics. State-of-the-art kinetic energy density functionals and ion–electron pseudopotentials are used to obtain accurate structural property predictions for nanoparticles, nanowires, extended surfaces, and nanoindentation of simple metals.     

合成2,4-二叔丁基苯酚工业试验

以离子交换树脂为催化剂，苯酚和甲基叔丁基醚为原料合成2，4-二叔丁基苯酚(简称2，4酚)，合成产物经过滤再经间歇真空精馏精制提纯，得到高纯度的2，4酚成品。成品精馏后釜中残液在酸性白土催化剂的作用下通过歧化反应生成对叔丁基苯酚，再经精馏提纯得到成品对叔丁基苯酚。通过工艺优化，使2，4酚、对叔丁基苯酚形成联产生产工艺，降低了生产原料消耗和成本。     

初春施工技术要点探讨

论述了初春施工这个特定的施工季节所具有的特征，从气候、施工人员、工程情况及受冻土体等方面对初春施工易出现的问题进行了分析，对施工过程及施工技术规律性问题做了细化性研究和探讨。     

时空效应规律在软土深基坑工程中的运用

阐述了时空效应规律在软土深基坑工程中的运用情况，实践证明，运用时空效应规律，能可靠而合理地利用土体自身在基坑开挖过程中控制土体位移的潜力而达到保护环境的目的。     

Bibliometric analysis of tsunami research

The use of the bibilometric analytical technique for examining tsunami research does not exist in the literature. The objective of the study was to perform a bibliometric analysis of all tsunami-related publications in the Science Citation Index (SCI). Analyzed parameters included document type, language of publication, publication output, authorship, publication patterns, distribution of subject category, distribution of author keywords, country of publication, most-frequently cited article, and document distribution after the Indonesia tsunami. The US and Japan produced 53% of the total output where the seven major industrial countries accounted for the majority of the total production. English was the dominant language, comprising 95% of articles. A simulation model was applied to describe the relationship between the number of authors and the number of articles, the number of journals and the number of articles, and the percentage of total articles and the number of times a certain keyword was used. Moreover the tsunami publication patterns in the first 8 months after the Indonesia tsunami occurred on 26 December 2004 indicated a high percentage of non-article publications and more documents being published in journals with higher impact factors.     

巴彦浩特探区钻井液技术初探

巴彦浩特探区钻井液工艺技术的重点是，解决疏松砂砾岩地层水涌漏同层、侏罗系地层水的HCO3^-污染及可能出现的火成岩地层井塌复杂。结合内蒙古巴彦浩特探区地层和井身结构特点，采用了两性聚合物／氯化钾钻井液和氯化钾／石膏-聚磺钻井液体系。该体系抑制能力强，性能稳定．容易实现低固相、低密度近平衡钻井，保护储层效果好。对复杂情况采取了有针对性的处理办法：平稳操作和合理的钻井工程措施是预防水层涌漏同层和火成岩井塌复杂的重要手段；用井场易得的固井水泥或石膏配合烧碱处理HCO3^-污染简便易行；处理火成岩井塌复杂，控制合适的钻井液性能是必要的。     

多部件设备维修问题研究及遗传算法求解

合理组织设备维修，缩短设备维修时间是生产运营管理的一个重要环节。本文探讨了多部件设备维修的有效组织问题。考虑到维修工人对拆分后设备的不同部分具有不同的维修效率，提出了一种基于维修时间优化的决策方法，将其与经典指派方法进行了比较；进一步地，对这一NP-hard问题设计了遗传算法，通过数值例子讨论了其求解有效性。     

一种基于GE90-30PLC的飞剪自动控制系统

本文介绍了调整线材轧线精轧机前专用于切头的启停式飞剪的自动控制系统。该系统以GE90—30PLC为控制核心，辅以热金属HMD、光电编码器等元件，能很好地完成飞剪的剪切及定位。其中着重阐述了飞剪控制中各个重要参数的计算原理和方法。     

辽河催化裂化澄清油中间馏分热反应研究

采用先加入絮凝剂脱灰，再经减压蒸馏切割420～500℃馏分的方法，将辽河催化裂化澄清油预处理，考察了澄清油、加入絮凝剂脱灰后的澄清油以及脱灰后再减压蒸馏所得的中间馏分这3种原料在热转化过程中中间相的转化历程，并采用偏光显微镜观察热转化产物。结果表明，澄清油预处理效果明显，所得中间馏分具有较低的H／C原子比（nH／nC）和适宜的组成分布，是生产针状焦的理想原料。热转化产物的光学组织结构属于各向异性发达的广域-流线型结构。     

An Interval Fuzzy Multiobjective Watershed Management Model for the Lake Qionghai Watershed, China

Integrated watershed management is required to ensure the reasonable use of resources and reconcile interactions among natural and human systems. In the present study, an interval fuzzy multiobjective programming (IFMOP) method was used to solve an integrated watershed management problem. Based on system analysis, an IFMOP model suitable for a lake watershed system {IFMOPLWS} was developed and applied to the Lake Qionghai watershed in China. Scenario analysis and an interactive approach were used in the solution process. In this manner, various system components were incorporated into one framework for holistic consideration and optimization. Integrality and uncertainty, as well as the multiobjective and dynamic characteristics of the watershed system, were well addressed. Using two scenarios, two planning schemes were generated. Agriculture, tourism, macroeconomics, cropland use, water supply, forest coverage, soil erosion, and water pollution were fully interpreted and compared to identify a preferable planning alternative for local agencies. This study showed that the IFMOPLWS is a powerful tool for integrated watershed management planning and can provide a solid base for sustainable watershed management.