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Moleküler Dinamik Benzetim Yönteminde Atom Sayısının Kristallesme Süreci Üzerine Etkisi (Seri B)

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Abstract (2. Language): 
This study has modelled CuAINi ternary alloy system through the use of the Parinello-Rahman molecular dynamic simulation method and examined the structural characteristics of this model during transition from amorphous phase to the crystal one. Furthermore, the effect of the quantity of atoms constituting MD cells on the crystallization time of this process has been investigated. Then, the number of 1421 bonded pairs has been analyzed by the Honeycut-Andersen method.
Abstract (Original Language): 
Bu çalışmada, Parinello-Rahman molekuler dinamik (MD) metodu kullanılarak CuAlNi uçlu alaşım sistemi modellenmiş ve model sistemin yapısal Özellikleri amorf fazdan kristal faza dönüsüm sürecinde incelenmistir. Bu dönüsüm sürecinde, MD Imcresini olusturan atomların sayısının kristallesme zamanı uzerine olan etkisi arastırılmıs ve ala-sımdaki 1421 baglı ciftlerin sayısı Honeycutt ve Andersen (HA) metodu kullanılarak analiz edilmiçstir.
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