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中国物理学会期刊

微观相场法模拟Ni75Al5.3V19.7 中L12和D022结构反位缺陷的演化

CSTR: 32037.14.aps.58.631

Microscopic phase field simulation for the evolution of antisite defect of L12 structure and D022 structure in Ni75Al5.3V19.7 alloy

CSTR: 32037.14.aps.58.631
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  • 运用微观相场法研究Ni75Al5.3V19.7合金沉淀过程中L12结构和D022结构反位缺陷发现:在沉淀初期,L12结构反位缺陷AlNi,VNi,NiAl,D022结构反位缺陷VNi,AlNi 

    The antisite defect for L12-structure Ni3Al and D022-structure Ni3V of Ni75Al5.3V19.7 alloy is studied by microscopic phase field method in this paper. The results show that the concentration of antisite defects AlNi,VNi and NiAl for L12 structure,VNi, AlNi,Niv and AlV for D022 structure all decrease with precipitate process and reach to equilibrium values at the early stage of precipitation respectively. With the elapse of time, the two structures grow up while the concentrations of antisite defects always keep unchanged. The concentrations of equilibrium state antisite defects AlNi and VNi for L12 structure α site, VNi and AlNi for D022 structure α site are of the 10-2 order, and antisite defect NiAl for L12 structure β site, NiV for D022 structure β site are of 10-1 order, the two defects being the main antisite defects for the L12 and D022 structures. The addition element has a great site-preference for a certain ordered phase, V atom prefers to occupy L12 structure β site while Al atom prefers to occupy D022 structure α site.

     

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