材料期刊网

Affecting Factors and Improving Measures for Converter Gas Recovery

WANG Aihua , CAI Jiuju , LI Xiuping , WANG Ding , ZHOU Qingan

钢铁研究学报(英文版)

To change the undesirable present situation of recovering and using converter gas in steel plants in China, the basic approaches to improving the converter gas recovery rate were analyzed theoretically along with the change curves of the converter gas component content, based on the converter gas recovery system of Baosteel No2 steelmaking plant. The effects of converter device, raw material, air imbibed quantity, recovery restricted condition, and intensity of oxygen blowing on the converter gas recovery rate were studied. Among these, the effects of the air imbibed quantity, recovery restricted condition, and intensity of oxygen blowing are remarkable. Comprehensive measures were put forward for improving the converter gas recovery from the point of devices, etc, and good results were achieved.

关键词: steel plant;converter gas;recovery rate;affecting factor

Two-step magnetization in a spin-chain system on the triangular lattice: Wang-Landau simulation

Physical Review B

The Wang-Landau algorithm is used to study the thermodynamic and magnetic properties of triangular spin-chain system based on two-dimensional Ising model in order to understand the magnetic-order dynamics in Ca(3)Co(2)O(6) compound. The calculated results demonstrate that the equilibrium state of the rigid spins produces the two-step magnetization curve at low temperature even when the random-exchange term is considered. This work indicates that the four-step magnetization behavior observed experimentally must be due to the nonequilibrium magnetization.

关键词: calcium compounds;exchange interactions (electron);Ising model;magnetisation;thermodynamics;one-dimensional ca3co2o6;density-of-states;compound ca3co2o6;phase-diagram;proteins;crystal

Ion sputter erosion in metallic glass-A response to "Comment on: Homogeneity of Zr(64.13)Cu(15.75)Ni(10.12)Al(10) bulk metallic glass" by L-Y. Chen, Y-W. Zeng, Q-P. Cao, B-J. Park, Y-M. Chen, K. Hono, U. Vainio, Z-L. Zhang, U. Kaiser, X-D. Wang, and J-Z Jiang J. Mater. Res. 24, 3116 (2009)

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

Novel Reduced-friction Materials by Laser Cladding of Copper Alloy on Cast Iron

Xichen YANG Milin ZHONG Tianxi ZHENG Naikun ZHANG Laser Processing Lab. , Tianjin Institute of Textile Science and Technology , Tianjin , 300160 , China

材料科学技术（英文）

Copper alloys suitable for laser cladding on cast iron are selected trom rune types of conventional powders. There are a poor spreading ability and porosity of copper alloy over the surface of castiron. Copper alloy surface is easily oxidized in atmosphere. These shortages have been overcome by ad- ding deoxidizers of Si and H_3BO_3. Laser parameters, stress and coefficient of friction have been ex- amined, and the larger smooth surface of Cu/cast iron for friction by laser cladding has been made for the application of the guide shoes of machine.

关键词: laser cladding , null , null

Effect of interstitial hydrogen on cohesive strength of Al grain boundary with Mg segregation

材料科学技术（英文）

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

Effect of Interstitial Hydrogen on Cohesive Strength of Al Grain Boundary with Mg Segregation

Xiaoguang LIU , Xiaowei WANG

材料科学技术（英文）

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

环氧树脂中电树枝生长特性及其动力学模型的实验验证

杨文虎 , 易冉 , 徐阳 , 惠思思 , 曹晓珑

绝缘材料 doi:10.3969/j.issn.1009-9239.2012.01.014

研究了不同外施工频电压下环氧树脂绝缘中的电树枝结构、生长的特性,并用Ding等提出的模型解释了电树枝的发展过程,模拟了其生长曲线.结果表明:在同一电压下,环氧树脂中电树枝的生长速度基本为恒定值,随外施电压的升高,电树枝分枝变少,生长速度基本呈指数增加,且利用模型模拟的生长曲线与实验测试的结果吻合,最后讨论了模型的物理基础.

关键词: 电树枝 , 环氧树脂 , 劣化 , 动力学 , 模型 , 模拟

Miedema模型在含O和S熔体与合金中的扩展与应用

陈伟亮 , 张宁 , 唐昭辉 , 丁学勇

材料研究学报

将Miedema模型与实验数据相结合得到适于Miedema模型的O和S的参数(O:电负性7.04、电子密度6.03、摩尔体积4.59;S:电负性5.8、电子密度3.24、摩尔体积6.97),计算了141种O的二元化合物和145种S的二元化合物生成焓其平均绝对误差(MAPE)分别为36.8％、32.4％.结合Ding导出的三元系相互作用系数计算模型,计算了1873 K时Fe基熔体中O和S与其它元素之间的相互作用系数.与实验数据的比较表明,除个别元素外,计算值与实验值之间误差不大且变化趋势比较一致.将误差较大的Nb、Ag、Pt的电负性参数由原来的4.05、4.35、5.65修正为4.31、4.17、5.57,使用Miedema模型的计算精度有很大的提高.

关键词: 材料科学基础学科 , Miedema模型 , 含O和S熔体与合金 , 相互作用系数 , 参数的修正

First-principles study on the effect of Mn and N on the cohesion of a gamma-iron grain boundary

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

First-principle study of electronic properties of Ti3Si1-xAlxC2 solid solutions

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