Impact of three-body interactions in a ReaxFF force field for Ni and Cr transition metals and their alloys on the prediction of thermal and mechanical properties
出版年份 2021 全文链接
标题
Impact of three-body interactions in a ReaxFF force field for Ni and Cr transition metals and their alloys on the prediction of thermal and mechanical properties
作者
关键词
Cr/Ni, ReaxFF, Three-body interaction, Elastic constant, Thermal expansion
出版物
COMPUTATIONAL MATERIALS SCIENCE
Volume 197, Issue -, Pages 110602
出版商
Elsevier BV
发表日期
2021-06-18
DOI
10.1016/j.commatsci.2021.110602
参考文献
相关参考文献
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