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當量成分AB和A3B型合金有序─無序轉變行為

Order-disorder Transition Behaviors of Stoichiometrical AB and A3B Alloys

  • 摘要: 利用EAM(Embedded Atom Method)勢基礎上的等效原子模型分析了結構穩定性與長程有序度的關系,給出了二元體系結合能與長程有序度解析關系的一般表達式,說明當量成分下AB和A3B型合金有序無序轉變行為的不同,并以NiAl和Ni3Al為研究對象具體研究了其有序無序轉變,從理論上解釋了這兩種有序金屬間化合物在實驗中所表現出的不同有序無序轉變行為特征.

     

    Abstract: The order-disorder transitions of stoichiometrical AB and A3B alloys were studied by using effective-atom model based on EAM (embedded atom method) potential.The results give the analytic function form of the free energy in term of the long range order (LRO) parameter,and indicate that order-disorder transition behaviors of stoichiometrical AB and A3B alloys may be different. This method can be applied to interpret the experimental results of order-disorder transition in stoichiometrical NiAl and Ni3Al.

     

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