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国家自然科学基金(50071009)

作品数:8 被引量:69H指数:3
相关作者:乔芝郁徐军郝士明曹战民谢允安更多>>
相关机构:北京科技大学东北大学昆明理工大学更多>>
发文基金:国家自然科学基金国家教育部博士点基金云南省科技攻关计划更多>>
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8 条 记 录,以下是 1-7
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M-Cu(M:Fe,Co)合金亚稳液相分离时液相间的界面能被引量:3
2003年
基于Becker界面能模型,由合金相图和液态合金的过剩热力学数据,计算了M-Cu (M:Fe,Co)包晶合金亚稳液相分离时液相间的界面能.
徐军乔芝郁
关键词:界面能相图
无铅锡基钎料合金设计和合金相图及其计算被引量:20
2004年
阐述了无铅钎料合金设计的原则,讨论了合金相图及其计算在无铅锡基钎料合金设计中的作用。利用相图计算技术筛选了可能代替Pb Sn共晶钎料合金的Sn Zn In三元(x(Zn)<0.11,x(In)=0.10~0.14)和Sn Zn In Ag四元(x(Sn)=0.800,x(In)=0.090,x(Zn)=0.075,x(Ag)<0.049)无铅锡基钎料合金。初步讨论了用相图计算技术在富Sn四元Sn Zn In Ag无铅钎料合金基础上,添加Bi,Sb等低熔点金属和微量Ce,La等稀土元素以降低贵金属In和Ag的含量,进一步提高无铅锡基多元合金钎料的综合性能和性能价格比。
乔芝郁谢允安曹战民袁文霞孙勇祁更新
关键词:钎料合金无铅钎料相图相图计算
Molten salt phase diagram evaluation by pattern recognition:Part I Divalent rare earth halide and alkali metal halide binary systems
2002年
At present CALPHAD (CALculation of PHAse Diagram) technique is notcapable of predicting whether there exists intermediate compound,much less predicting the formulae, the number, and the meltingcongruence of intermedi- ate compounds. To solve this problem, a newapproach called the phase diagram evaluation by pattern recognition(PDEPR) was improved. The micro-parameters. Such as the radius andthe electronegativity of the different features in multi-dimensionalspace.
SUNYiminQIAOZhiyu
关键词:PHASEDIAGRAM
Prediction of surface and interfacial tension based on thermodynamic data and CALPHAD approach被引量:3
2006年
In this article, following a brief introduction concerning experimental measurements of surface and interfacial tensions, methods for calculating surface tension and surface segregation for binary, ternary, and multicomponent high-temperature melts based on Bulter's original treatment [ 1] and on available physical properties and thermodynamic data, especially excess Gibbs free energies of bulk phase and surface phase versus temperature obtained from thermodynamic databases using the calculation of phase diagram (CALPHAD) approach, with special attention to the model parameter β, have been described. In addition, the geometric models can be extended to predict surface tensions of multicom- ponent systems from those of sub-binary systems. For illustration, some calculated examples, including Pb-free soldering systems and phase-diagram evaluation of binary alloys in nanoparticle systems are given. On the basis of surface tensions of high-temperature melts, interracial tensions between liquid alloy and molten slag as well as molten slag and molten matter can be calculated using the Girifalco-Good equation [2]. Modifications are suggested in the Nishizawa's model [3] for estimation of interracial tension in liquid metal (A)/ceramics (MX) systems so that the calculations can be carried out based on the sublattice model and thermodynamic data, without deliberately differentiating the phase of MX at high temperature. Finally, the derivation of an approximate expression for predicting interfacial tension between the high-temperature multicomponent melts, employing Becker's model [4] in conjunction with Bulter's equation and inteffacial tension data of the simple systems is described, and some examples concerning pyrometallurgical systems are given for better understanding.
QIAO ZhiyuCAO ZhanminTanaka Toshihiro
关键词:THERMODYNAMICS
相图计算研究的进展被引量:43
2005年
相图计算作为材料设计的一部分受到了人门更多的重视.本文概述了相图计算的优点,简要评述了相图计算方法的发展现状和前沿研究,着重强调了将第一性原理计算和相图计算方法相结合以及基于相图计算热力学数据库预测体系物理性质对于材料设计和冶金过程优化的重要性.
乔芝郁郝士明
关键词:相图计算热力学动力学第一性原理计算
Surface Tension Calculation of Undercooled Alloys被引量:2
2001年
Based on the Butler equation and extrapolated thermodynamic data of undercooled alloys from those of liquid stable alloys, a method for surface tension calculation of undercooled alloys is proposed. The surface tensions of liquid stable and undercooled Ni-Cu (x(Ni)=0.42) and Ni-Fe (x(Ni)=0.3 and 0.7) alloys are calculated using STCBE (Surface Tension Calculation based on Butler Equation) program. The agreement between calculated values and experimental data is good enough, and the temperature dependence of the surface tension can be reasonable down to 150-200 K under the liquid temperature of the alloys.
Zhiyu Qiao, Lijun Yan, Zhanmin Cao, Guirong Liu (Department of Physical Chemistry, University of Science and Technology Beijing, Beijing 100083, China)
液态和过冷态Fe-20%Cu合金表面张力的测定与计算
2003年
利用电磁悬浮液滴振荡法测定了液态和过冷态Fe-20%Cu合金的表面张力,测定表明在1580~1900 K温度范围内液态和过冷态Fe-20%Cu合金表面张力与温度变化的关系满足方程σFe-20%Cu=1.658-2.234×10^(-4)(T-1803 K)。利用基于Butler方程和相图计算技术的表面张力计算软件(STCBE)计算了该合金的表面张力,计算值与实验值在误差范围内相吻合。
徐军乔芝郁韩秀君魏炳波
关键词:物理化学性质液态相图
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