Molecular dynamics simulation of primary irradiation defect formation in Fe-10%Cr alloy

Journal of Nuclear Materials

Volumn 351, Issue 1-3, 2006, Pages 56-64

  Shim, Jae Hyeok ^a,b   Lee, Hyon Jee ^a   Wirth, Brian D ^a  

^a Etcheverry Hall MCI 730   (United States)

^b Korea Institute of Science and Technology   (South Korea)

Author keywords

F0800; I0500; M0200; R0100

Indexed keywords

BINDING ENERGY; CHEMICAL BONDS; COMPUTER SIMULATION; ELECTRIC POTENTIAL; IRON; MOLECULAR DYNAMICS; POINT DEFECTS;

F0800; I0500; M0200; R0100;

CHROMIUM ALLOYS;

EID: 33746783806     PISSN: 00223115     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jnucmat.2006.02.021     Document Type: Article

References (36)

1. Calder A.F., and Bacon D.J. J. Nucl. Mater. 207 (1993) 25
2. Stoller R.E., Odette G.R., and Wirth B.D. J. Nucl. Mater. 251 (1997) 49
3. Soneda N., and Diaz de la Rubia T. Philos. Mag. A 78 (1998) 995
4. Becquart C.S., Domain C., Legis A., and Van Duysen J.C. J. Nucl. Mater. 280 (2000) 73
5. Malerba L., Terentyev D., Olsson P., Chakarova R., and Wallenius J. J. Nucl. Mater. 329-333 (2004) 1156
6. Wallenius J., Olsson P., Lagerstedt C., Sandbers N., Chakarova R., and Pontikis V. Phys. Rev. B. 69 (2004) 094103
7. Daw M.S., and Baskes M.I. Phys. Rev. Lett. 50 (1983) 1285
8. Farkas D., Schon C.G., de Lima M.S.F., and Goldstein H. Acta Mater. 44 (1996) 409
9. Terentyev D., and Malerba L. J. Nucl. Mater. 329-333 (2004) 1161
10. Maeta H., Ono F., and Kittaka T. J. Phys. Soc. Jpn. 53 (1984) 4353
11. Domain C., and Becquart C.S. Phys. Rev. B. 65 (2001) 024103
12. Fu C.-C., Willaime F., and Ordejón P. Phys. Rev. Lett. 92 (2004) 175503
13. Wirth B.D., Odette G.R., Maroudas D., and Lucas G.E. J. Nucl. Mater. 244 (1997) 185
14. Ackland G.J., Bacon D.J., Calder A.F., and Harry T. Philos. Mag. A 75 (1997) 713
15. Mendelev M.I., Han S., Srolovitz D.J., Ackland G.J., Sun D.Y., and Asta M. Philos. Mag. 83 (2003) 3977
16. Wollenberger H.J. In: Cahn R.W., and Haasen P. (Eds). Physical Metallurgy. 3rd Ed. (1983), Elsevier, Amsterdam 1139
17. Finnis M.W., and Sinclair J.E. Philos. Mag. A 50 (1984) 45
18. Rose J.H., Smith J.R., Guinea F., and Ferrante J. Phys. Rev. B 29 (1984) 2963
19. Konishi T., Ohsawa K., Abe H., and Kuramoto E. Comput. Mater. Sci. 14 (1999) 108
20. Ackland G.J., and Vitek V. Phys. Rev. B 41 (1990) 10324
21. Andersson J.-O., and Sundman B. Calphad 11 (1987) 83
22. Dench W.A. Trans. Faraday Soc. 59 (1963) 1279
23. Leslie W., Sober R.J., Babcock S.G., and Green S.J. Trans. Am. Soc. Met. 62 (1969) 690
24. Abrahamson E.P., and Lopata S.L. Trans. Metall. Soc. AIME 236 (1966) 76
25. Pearson W.B. A Handbook of Lattice Spacings and Structures of Metals and Alloys (1958), Pergamon, New York p. 532
26. C. Domain, private communication.
27. http://www.cs.sandia.gov/~paschul/Quest.
28. Perdew J.P., Burke K., and Ernzerhof M. Phys. Rev. Lett. 77 (1996) 3865
29. Diaz de la Rubia T., and Guinan M.W. J. Nucl. Mater. 174 (1990) 151
30. Parrinello M., and Rahman A. Phys. Rev. Lett. 45 (1980) 1196
31. Bacon D.J., Calder A.F., Gao F., Kapinos V.G., and Wooding S.J. Nucl. Instrum. and Meth. B 102 (1995) 37
32. Norgett M.J., Robinson M.T., and Torrens I.M. Nucl. Eng. Des. 33 (1975) 50
33. Maury F., Lucasson P., Lucasson A., Faudot F., and Bigot J. J. Phys. F: Met. Phys. 17 (1987) 1143
34. Abe H., and Kuramoto E. J. Nucl. Mater. 271&272 (1999) 209
35. Marian J., Wirth B.D., Perlado J.M., Odette G.R., and Diaz de la Rubia T. Phys. Rev. B 64 (2001) 094303
36. Arakawa K., Hatanaka M., Mori H., and Ono K. J. Nucl. Mater. 329-333 (2004) 1194