Influence of doping on the crystallization ability of mono-component materials | Zendy

Kun Peng | Zendy; Ming Chen | Zendy; Ye Xiang-Xi | Zendy; Wenxian Zhang | Zendy; Jun Zhuang | Zendy; Ning Xi-Jing | Zendy

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Influence of doping on the crystallization ability of mono-component materials

Author(s) -

Kun Peng,

Ming Chen,

Ye Xiang-Xi,

Wenxian Zhang,

Jun Zhuang,

Ning Xi-Jing

Publication year - 2010

Publication title -

acta physica sinica

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.199

H-Index - 47

ISSN - 1000-3290

DOI - 10.7498/aps.59.7245

Subject(s) - crystallization , materials science , component (thermodynamics) , doping , binary number , work (physics) , crystal (programming language) , molecular dynamics , thermodynamics , chemical physics , computational chemistry , computer science , chemistry , physics , optoelectronics , arithmetic , mathematics , programming language

Recently, we developed a condensing potential model to predict the ability for materials to form single crystals, and it showed that the ability of mono-component materials (Ni, Al, Cu, Ar, Mg) increases monotonically with the increasing condensing potentials. The present work applied the condensing potential model to binary-component materials. Via molecular dynamics simulations, we investigated the influence of 6 wt% Al doping on the crystallization ability of Ni crystal and found that the doping heavily decreased the crystallization ability. Then a condensing potential model for binary-component materials was developed and was shown as a promising tool to predict the crystallization ability of binary-component materials.

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