Chun-wen WANG
,
Jr-hau HE
材料科学技术（英）
Vertically aligned ZnO nanorods were synthesized on a-plane sapphire via a metal catalyzed vapor phase transport and condensation process in a two-zone vacuum furnace. Planar-tip and tapered-tip ZnO nanorods were successfully synthesized by utilizing different source materials under the same growth conditions. The growth mechanisms were proposed to be vapor-liquid-solid (VLS) process for planar-tip ZnO nanorods and a combination of VLS and self-catalyzed processes for tapered-tip ZnO nanorods. From cathodoluminescence (CL) measurements, tapered-tip ZnO nanorods have more intense green emission than planar-tip ZnO nanorods, and therefore possess higher oxygen vacancy concentration than planar-tip ZnO nanorods. From CL characteristics, well-aligned planar-tip ZnO nanorods shall serve effectively as laser source, while well-aligned tapered-tip ZnO nanorods are suitable for direction-related optical applications.
关键词:
ZnO
,
well-aligned
,
nanorods
,
cathodolumines
Journal of Materials Research
The morphology of the dark and bright regions observed by transmission electron microscopy for the Zr(64.13)Cu(15.75)Ni(10.12)Al(10) bulk metallic glass strongly depends on the ion beam parameters used for ion milling. This indicates that the ion beam could introduce surface fluctuation to metallic glasses during ion milling.
关键词:
room-temperature
材料科学技术（英）
The effect of interstitial hydrogen on the cohesion of the Al Sigma=11(113) grain boundary (GB) is investigated based on the thermodynamic model of Rice-Wang using the first-principles density function calculation. The results indicate that interstitial H behaves as an embrittler from "strengthening energy" analysis. The reduced GB cohesion due to the presence of H at the GB is attributed to the low affinity between H and Al, and the weakened bonding of Al atomic pairs perpendicular to GB plane.
关键词:
hydrogen;grain boundary;Al-Mg alloys;pseudopotentials;1st-principles
Xiaoguang LIU
,
Xiaowei WANG
材料科学技术（英）
The effect of interstitial hydrogen on the cohesion of the Al ∑=11(113) grain boundary (GB) is investigated based on the thermodynamic model of Rice-Wang using the first-principles density function calculation. The results indicate that interstitial H behaves as an embrittler from "strengthening energy" analysis. The reduced GB cohesion due to the presence of H at the GB is attributed to the low affinity between H and Al, and the weakened bonding of Al atomic pairs perpendicular to GB plane.
关键词:
Hydrogen
,
null
,
null
Physical Review B
By use of the linear-combination-of-atomic-orbital (LCAO) method for a cluster model, we studied the electronic structure of gamma-from Sigma 11 [1 (1) over bar0](11 (3) over bar) grain boundary doping with N and Mn atoms. The effect of the segregation on the cohesion of the grain boundary is investigated based on the Rice-Wang thermodynamic model. It is found that N could not only largely enhance the cohesion of the grain boundary but also eliminate the detrimental effect of Mn. The cosegregation effect of Mn and N on the cohesion of the grain boundary depends on where they segregate. Nitrogen could be reliably used in alloyed steels as an efficient strengthening element.
关键词:
electronic-structure;phosphorus segregation;stainless-steel;embrittlement;austenite;nitrogen;boron;impurities;fracture;metals
周晓宏
,
刘红军
,
刘鹏
功能材料
优化技术是一种以数学为基础,可用来求解各种工程问题最优解的应用技术.本文利用磁流变阻尼器动态特性数据,采用遗传算法进行阻尼器模型参数识别优化过程,最终将得到的磁流变阻尼器模型参数用于土木工程结构振动控制研究.已建立的磁流变阻尼器的动力特性将在不同的电场强度和变化的位移幅度下进行测试,可以得到在不同位移和速度下恢复力的滞回曲线,建立Bouc-Wen模型.把根据试验得到的滞回曲线和使用遗传算法对模型参数进行优化的结果进行比较可知,这种模型的参数可以以十分小的误差得到优化.
关键词:
遗传算法
,
阻尼器
,
参数识别
吕友军
,
董旭斌
,
张天宁
工程热物理学报
本文采用基于颗粒动力学的欧拉双流体模型,对比研究了曳力和湍流对超临界水流化床传热特性的影响,选取了Gidaspow、Syamlal-O'Brien和Wen-Yu三种曳力模型以及标准κ-ε、RNG κ-ε、Realizable κ-ε湍流模型三种高Re数湍流模型及低Re数κ-ε湍流模型.研究结果表明,在三种曳力模型中,Gidaspow曳力模型在超临界水流化床中更为适用;对于所采用的四种κ-ε湍流模型,利用三种高雷诺数湍流模型模拟所得床层与壁面间传热系数基本一致且大于采用低雷诺数模型模拟所得传热系数,而综合考虑,RNGκ-s湍流模型更适于超临水流化床传热特性的研究.
关键词:
超临界水流化床
,
曳力
,
湍流
,
传热
朱奎松
,
刘松利
,
芶淑云
,
王梁
钢铁钒钛
doi:10.7513/j.issn.1004-7638.2017.02.005
基于欧拉-双流体模型和流态化氯化临界流化速度经验公式,结合云南高钛渣物性参数,研究了其流态化氯化的初始流化速度下高钛渣流态化氯化特性、气泡运动对床层的扰动、气泡大小与分布板位置关系.研究结果表明:Grace方程能准确预测B类颗粒窄粒径的高钛渣流态化氯化气泡行为,Wen-Yu方程预测的初始流化速度下乳相和气泡出现时间延后;完全流化速度下,通过上升、合并长大、破裂过程,在分布板位置形成气泡;通过钛渣固体矢量图得出,整个床层以气泡为分界,气泡上升对上、下部颗粒的流动产生影响,导致床层不均匀.
关键词:
四氯化钛
,
高钛渣
,
氯化
,
流化床
,
数值模拟
,
流动特性
Journal of Physics and Chemistry of Solids
The layered ternary ceramics Ti3SiC2 and Ti3AlC2 are isostructural and can form Ti3Si1-xAlxC2 solid solutions combining the advanced properties of both compounds [H.B. Zhang, Y.C. Zhou, Y.W. Bao, M.S. Li, Improving the oxidation resistance of Ti3SiC2 by forming a Ti3Si0.90Al0.1C2 solid solution, Acta Mater. 52 (2004) 3631-3637; E.D. Wu, J.Y. Wang, H.B. Zhang, Y.C. Zhou, K. Sun, Y.J. Xue, Neutron diffraction studies of Ti3Si0.9Al0.1C2 compound, Mater. Lett. 59 (2005) 2715-2719; J.Y. Wang, Y.C. Zhou, First-principles study of equilibrium properties and electronic structure of Ti3Si0.75Al0.25C2 solid solution, J. Phys.: Condens. Matter 15 (2003) 5959-5968; Y.C. Zhou, J.X. Chen, J.Y. Wang, Strengthening of Ti3AlC2 by incorporation of Si to form Ti3Al1-xSixC2 solid solutions, Acta. Mater. 54 (2006) 1317-1322]. In the present work, the solid solutions of Ti3Si1-xAlxC2 (x = 0, 0.25, 0.33, 0.5, 0.67, 0.75, 1) are investigated by first-principle calculations based on pseudo-potential plan-wave method within the density functional theory framework. The results show that as Al content increases in the solid solution, all the bonds have weakened to certain extents, which lead to an unstable structure both energetically and geometrically. The calculated results are compared and discussed with the reported data for the Ti3Si1-xAlxC2 solid solutions. (c) 2007 Elsevier Ltd. All rights reserved.
关键词:
ceramics;ab initio calculations;electronic structure;electrical;conductivity;oxidation behavior;mechanical-properties;ti3sic2;temperature;ti3alc2;air;si
