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Atomistic simulations of surface diffusion and segregation in ceramics

✍ Scribed by M.Yu. Lavrentiev; N.L. Allan; J.H. Harding; D.J. Harris; J.A. Purton

Book ID
116374342
Publisher
Elsevier Science
Year
2006
Tongue
English
Weight
267 KB
Volume
36
Category
Article
ISSN
0927-0256

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## Abstract Both the formation energies and the intra‐ and inter‐layer diffuse activation energies of a vacancy in the first six lattice planes of Mg (001) surface have been calculated by combining the modified analytical embedded‐atom method (MAEAM) with molecular dynamics (MD). The results show t