Exchange-correlation errors at harmonic and anharmonic orders: the case of bulk Cu

As an aid towards improving the treatment of exchange and correlation effects in electronic structure calculations, it is desirable to have a clear picture of the errors introduced by currently popular approximate exchange-correlation functionals. We have performed ab initio density functional theory and density functional perturbation theory calculations to investigate the thermal properties of bulk Cu, using both the local density approximation (LDA) and the generalized gradient approximation (GGA). Thermal effects are treated within the quasiharmonic approximation. We find that the LDA and GGA errors for anharmonic quantities are an order of magnitude smaller than for harmonic quantities; we argue that this might be a general feature. We also obtain much closer agreement with experiment than earlier, more approximate calculations.     

Electronic properties of magnetically doped nanotubes

Effect of doping of carbon nanotubes by magnetic transition metal atoms has been considered in this paper. In the case of semiconducting tubes, it was found that the system has zero magnetization, whereas in metallic tubes the valence electrons of the tube screen the magnetization of the dopants: the coupling to the tube is usually antiferromagnetic (except for Cr).     

聚丙烯腈基碳纤维市场分析与预测

本文介绍了国内外聚丙烯腈基碳纤维装置的生产能力和碳纤维的市场需求情况，提出了国内碳纤维所面临的挑战，并对如何发展国内碳纤维提了一些建议。     

勘探创造力的增强需要体制创新

建立一个与市场经济相适应的,对创造性劳动受到尊重、支持、鼓励的创新体制,是实现创造力持续增长的关键。为此就要在干部制度、分配奖励制度和资金管理制度上深入改革,进行制度创新,为培养造就综合素质强的复合型人才,使创造性工作能获得持久的动力与激励提供条件和保证。     

与供应商的采购合作关系分析

对与供应商的采购合作关系进行了初步的分析，通过需求分析、选择供应商、正式建立合作关系、实施和加强合作关系4个过程展开，分别对筛选战略、供应管理计划流程、供应商的评估和选择、认证管理等关键问题进行初步分析，旨在使采购工作趋于完美。     

多臂井径成像测井技术

多臂井径成像测井技术同以往的40臂、X—Y井径等非成像工程测井相比具有较为明显的优势，不但可以做定量解释提供最大、最小、平均井径值，而且可以提供更为直观的18条或36务独立的测井曲线、磁井径，磁重量、井温、井壁立体图、井壁成像图、井壁截面图，为检测井下套管的完好性及修复提供了更为可靠直观的资料，满足了地质学家及时监测套管状况的要求，也为油井作业、大修提供全面、准确的套管全貌。文章介绍了18臂、36臂两种井径成像测井技术。并通过对测试资料实例的解释、分析、研究，总结了多臂井径成像测井技术的特点及应用效果。     

基于贝叶斯理论的城市供水管网泄漏在线检测与定位

许多城市的供水管网都安装了SCADA(Supervisory Control And Data Acquisition)系统,基于SCADA系统监测到的数据可对管网泄漏进行检测。通过引进统计学概率论中一基本定理——贝叶斯定理来建立管网泄漏的在线检测与定位模型,一定程度上解决了水力模拟误差、测量误差、测点配置等因素导致的不确定性问题。模型通过实例考核取得较为满意的诊断结果。     

催化裂化汽油固体碱脱硫-固定床脱臭组合工艺的开发

在对活性剂、活化剂等对固体碱脱除硫化氢性能影响研究的基础上,对催化裂化汽油固体碱脱硫-固定床脱臭组合工艺进行了实验室小试,结果表明,固体碱完全可以取代液体碱而用于催化裂化汽油的精制.相对于液体碱洗-固定床脱臭工艺,无论再生前还是再生后,固体碱脱硫-固定床脱臭组合工艺使装置运转时间延长一倍以上.介绍了该组合工艺的流程设计和工业应用.     

浅谈如何有效学习计算机软件知识

计算机软件知识的学习并不是完全线性的，而是不断循环往复、迭代的过程。本对如何深入、广泛、有效地学习计算机软件知识做出了一些探讨。     

Image registration by "Super-curves"

We solve the 2-D affine image registration problem by curve matching and alignment. Our approach starts with a super-curve, which is formed by superimposing two affine related curves in one coordinate system. We use B-spline fusion technique to find a single B-spline approximation of the super-curve and a registration between the two curves simultaneously. This approach achieves superior accuracy and efficiency in curve matching and alignment. We then address the occlusion problem by finding partial match between the curves segmented using inflections and cusps, which are affine invariant. The combination of edge detection and curve alignment lead to accurate image registration.