Atomic size and chemical effects of alloying elements Cu, Mg and Si on the structure and dynamics of molten 8090-based AlLi alloy

doi:10.1080/13640461.2017.1371471

IMR OpenIR

	Atomic size and chemical effects of alloying elements Cu, Mg and Si on the structure and dynamics of molten 8090-based AlLi alloy
	Zhu, Xunming 1; Liu, Dan 1; Wang, Aimin 1; Duan, Junpeng 1; Yang, Yuansheng 2; Tang, Shouqiu 3; Qin, Jingyu 4
通讯作者	Liu, Dan(0617082@zju.edu.cn)
	2018
发表期刊	INTERNATIONAL JOURNAL OF CAST METALS RESEARCH
ISSN	1364-0461
卷号	31 期号:2 页码:93-98
摘要	The structural and dynamical properties of liquid Al91Li9 and Al91Li9M3 (M=Cu, Mg, Si) alloys are investigated by means of ab initio molecular dynamic simulation. Pair distribution function analysis suggests that the atomic distances of Li-Li and Al-Li decrease after addition of alloying elements. The additive Cu and Si are manifested surrounded by Al and Li and hardly meet each other owing to the effects of atom size and their negative mixing enthalpy with Li. The topological environments of Al and Li in Al91Li9 are changed significantly by adding minor alloying elements. The diffusion of Al and Li is hindered by alloying elements, among which Cu and Si play more significant role. Furthermore, the metalloid additive Si illustrates different effects from the metallic additive Cu and Mg on the diffusivity of Al91Li9 liquid alloys.
关键词	Al-Li alloy molecular dynamic simulation liquid alloy short-range order
DOI	10.1080/13640461.2017.1371471
收录类别	SCI
语种	英语
WOS研究方向	Metallurgy & Metallurgical Engineering
WOS类目	Metallurgy & Metallurgical Engineering
WOS记录号	WOS:000428583600005
出版者	TAYLOR & FRANCIS LTD
引用统计	被引频次：3[WOS] [WOS记录] [WOS相关记录]
文献类型	期刊论文
条目标识符	http://ir.imr.ac.cn/handle/321006/127737
专题	中国科学院金属研究所
通讯作者	Liu, Dan
作者单位	1.Weihai Wanfeng Magnesium Ind Sci & Technol Dev Co, Weihai, Peoples R China 2.Chinese Acad Sci, Inst Met Res, Shenyang, Liaoning, Peoples R China 3.Shandong Acad Sci, Adv Mat Inst, Jinan, Shandong, Peoples R China 4.Shandong Univ, Minist Educ, Key Lab Liquid Solid Struct Evolut & Proc Mat, Jinan, Shandong, Peoples R China
推荐引用方式 GB/T 7714	Zhu, Xunming,Liu, Dan,Wang, Aimin,et al. Atomic size and chemical effects of alloying elements Cu, Mg and Si on the structure and dynamics of molten 8090-based AlLi alloy[J]. INTERNATIONAL JOURNAL OF CAST METALS RESEARCH,2018,31(2):93-98.
APA	Zhu, Xunming.,Liu, Dan.,Wang, Aimin.,Duan, Junpeng.,Yang, Yuansheng.,...&Qin, Jingyu.(2018).Atomic size and chemical effects of alloying elements Cu, Mg and Si on the structure and dynamics of molten 8090-based AlLi alloy.INTERNATIONAL JOURNAL OF CAST METALS RESEARCH,31(2),93-98.
MLA	Zhu, Xunming,et al."Atomic size and chemical effects of alloying elements Cu, Mg and Si on the structure and dynamics of molten 8090-based AlLi alloy".INTERNATIONAL JOURNAL OF CAST METALS RESEARCH 31.2(2018):93-98.