作者
RE Stoller, GR Odette, BD Wirth
发表日期
1997/11/11
期刊
Journal of Nuclear Materials
卷号
251
页码范围
49-60
出版商
North-Holland
简介
Primary defect formation in bee iron has been extensively investigated using the methods of molecular dynamics (MD) and Monte Carlo (MC) simulation. This research has employed a modified version of the Finnis-Sinclair interatomic potential. MD was used in the simulation of displacement cascades with energies up to 40 keV and to examine the migration of the interstitial clusters that were observed to form in the cascade simulations. Interstitial cluster binding energies and the stable cluster configurations were determined by structural relaxation and energy minimization using a MC method with simulated annealing. Clusters containing up to 19 interstitials were examined. Taken together with the previous work, these new simulations provide a reasonably complete description of primary defect formation in iron. The results of the displacement cascade simulations have been used to characterize the energy and …
引用总数
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学术搜索中的文章
RE Stoller, GR Odette, BD Wirth - Journal of Nuclear Materials, 1997