Title of article
Development of a pair potential for Fe–He by lattice inversion
Author/Authors
Chen، نويسنده , , P.H. and Lai، نويسنده , , X.C. and Liu، نويسنده , , K.Z. and Wang، نويسنده , , X.L. and Bai، نويسنده , , B. and Ao، نويسنده , , B.Y. and Long، نويسنده , , Y.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2010
Pages
4
From page
156
To page
159
Abstract
A new pair potential for helium in bulk iron was developed using a method based on the Chen–Möbius lattice inversion in order to study the effect of He in irradiated iron. By means of molecular dynamic (MD), we have examined this interatomic potential. Comparing with the ab initio calculation results, the stability of He-vacancy clusters at zero temperature and migration energy was well reproduced by this potential.
Journal title
Journal of Nuclear Materials
Serial Year
2010
Journal title
Journal of Nuclear Materials
Record number
1363466
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