Embedded atom method study of the interaction between point defects in iron aluminides: Triple defects

Intermetallics

Volumn 13, Issue 11, 2005, Pages 1245-1254

  Nogueira, Renata N ^a   Schön, Cláudio G ^a  

^a UNIVERSITY OF SÃO PAULO   (Brazil)

Author keywords

A. Iron aluminides (based on FeAl); B. Bonding; D. Defects: point defects; E. Defects, theory; E. Simulations atomistic

Indexed keywords

CHEMICAL BONDS; COMPLEXATION; COMPUTER SIMULATION; CRYSTAL STRUCTURE; IRON COMPOUNDS; POINT DEFECTS;

DEFECTS, THEORY; IRON ALUMINIDES (BASED ON FEAL); POSITRON ANNIHILATION; SIMULATIONS ATOMISTICS;

INTERMETALLICS;

EID: 21444436878     PISSN: 09669795     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.intermet.2005.04.008     Document Type: Article

References (31)

1. Nogueira RN, Schön CG, Intermetallics in press.
2. H. Mehrer Mater Trans JIM 37 1996 1259 1280
3. S. Divinski, and C. Herzig Intermetallics 8 2000 1357 1368
4. R. Drautz, and M. Fähnle Acta Mater 47 1999 2437 2447
5. I.V. Belova, and G.E. Murch J Phys Condens Matter 14 2002 9563 9577
6. W. Frantz, and R. Lück J Alloys Comp 220 1995 231 236
7. R. Kozubski, D. Kmiec, E. Partika, and M. Danielewski Intermetallics 11 2003 897 905
8. Y. Minamino, Y. Kiozumi, N. Tsuji, M. Morioka, K. Hirao, and Y. Shirai Sci Tech Adv Mater 1 2000 237 249
9. R. Nakamura, K. Fujita, Y. Yijima, and M. Okada Acta Mater 51 2003 3861 3870
10. M. Huang, F. Xie, X. Yan, and Y.A. Chang Intermetallics 9 2001 457 460
11. L.M. Pike, I.M. Anderson, C.T. Liu, and Y.A. Chang Acta Mater 50 2002 3859 3879
12. W. Frantz, R. Lück, and B. Predel J Alloys Comp 247 1997 206 209
13. J. Wolff, M. Franz, A. Broska, B. Köhler, and Th. Hehenkamp Mater Sci Eng A239-240 1997 213 217
14. A.H. Cottrell Intermetallics 5 1997 467 469
15. P.A. Korzhavyi, A.V. Ruban, A.Y. Lozovoi, Y.K. Vekilov, I.A. Abrikozov, and B. Johanson Phys Rev B 61 2000 6003 6018
16. S.V. Divinski, and L.N. Larikov J Phys Condens Matter 9 1997 7873 7883
17. R. Krachler, H. Ipser, B. Sepiol, and G. Vogl Intermetallics 3 1995 83 88
18. M. Kogachi, T. Haraguchi, and S.M. Kim Intermetallics 6 1998 499 510
19. M. Kogachi, and T. Haraguchi Intermetallics 7 1999 981 993
20. J. Bogner, W. Steiner, M. Reissner, P. Mohn, P. Blaha, and K. Schwartz Phys Rev B 58 1998 14922 14933
21. J. Wolff, M. Franz, A. Broska, R. Kerl, M. Weinhagen, and B. Köhler Intermetallics 7 1997 289 300
22. M. Fähnle, B. Meyer, G. Bester, J. Majer, and N. Bornsen Defect Diffus Forum 194 2001 279 285
23. D.R. Noakes, A.S. Arrot, M.G. Belk, S.C. Deevi, Q.Z. Huang, and J.W. Lynn Phys Rev Lett 21 2003 217201
24. P. Mohn, C. Persson, P. Blaha, K.S. Schwarz, P. Novák, and H. Eschrig Phys Rev Lett 87 2001 196401
25. F. Lechermann, F. Welsch, C. Ederer, M. Fähnle, J.M. Sanchez, and B. Meyer Phys Rev B 65 2002 132104
26. F. Lechermann, M. Fähnle, B. Meyer, and C. Elsässer Phys Rev B 69 2004 165116
27. A.G. Petukhov, I.I. Mazin, L.L. Chioncel, and A.I. Lichtenstein Phys Rev B 67 2003 153106
28. D.A. Papaconstantopoulos, and C.S. Hellberg Phys Rev Lett 89 2002 29701
29. P.G. Gonzales-Ormeño, H.M. Petrilli, and C.G. Schön CALPHAD 26 2002 573 582
30. Gonzales-Ormeño PG, Nogueira RN, Schön CG, Petrilli HM, Acta Mater. (submitted).
31. Y. Mishin, A.Y. Lozovoi, and A. Alavi Phys Rev B 67 2003 014201