Local environment effects in the vibrational properties of disordered alloys: An embedded-atom method study of Ni3Al and Cu3Au

Journal of Phase Equilibria

Volumn 19, Issue 6, 1998, Pages 559-567

  Morgan, D ^a   Althoff, J D ^a   De Fontaine, D ^a  

^a Lawrence Berkeley National Laboratory   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; COPPER ALLOYS; CRYSTAL ATOMIC STRUCTURE; ELECTRONIC DENSITY OF STATES; ENTROPY; MOLECULAR VIBRATIONS; NICKEL ALLOYS; RELAXATION PROCESSES;

EMBEDDED ATOM METHOD;

BINARY ALLOYS;

EID: 0032305360     PISSN: 10549714     EISSN: None     Source Type: Journal    
DOI: 10.1361/105497198770341752     Document Type: Article

References (31)

1. L. Anthony, J.K. Okamoto, and B. Fultz, Phys. Rev. Lett., 70, 1128 (1993).
2. B. Fultz, L. Anthony, L.J. Nagel, R.M. Nicklow, and S. Spooner, Phys. Rev. B, 52, 3315 (1995).
3. L.J. Nagel, L. Anthony, and B. Fultz, Philos. Mag. Lett., 72, 421 (1995).
4. F. Cleri and V. Rosato, Philos. Mag. Lett., 67, 369 (1993).
5. G.J. Ackland, Alloy Modeling and Design, G. Stocks and P. Turchi, Ed., The Minerals, Metals, and Materials Society, Warrendale, PA, 149 (1994).
6. J.D. Althoff, D. Morgan, D. de Fontaine, M. Asta, S.M. Foiles, and D.D. Johnson. Phys. Rev. B, 56, R5705 (1997).
7. R. Ravelo, J. Aguilar, M. Baskes, J.E. Angelo, B. Fultz, and B.L. Holian, Phys. Rev. B, 57, 862 (1998)
8. A. van de Walle and G. Ceder, Phys. Rev. Lett., 80, 4911 (1998)
9. M.S. Daw and M.I. Baskes, Phys. Rev. B, 29, 6443 (1984).
10. M.S. Daw, S.M. Foiles, and M.I. Baskes, Mater. Sci. Rep., 9, 251 (1993).
11. A.A. Maradudin, E.W. Montroll, G.H. Weiss, and I.P. Ipatova, Theory of Lattice Dynamics in the Harmonic Approximation, 2nd ed., Academic Press, New York (1971).
12. J. Callaway, Quantum Theory of the Solid State, Academic Press, San Diego, CA (1974).
13. J.M. Sanchez, F. Ducastelle, and D. Gratias, Physica, 128A, 334 (1984).
14. D. de Fontaine, Solid State Phys., 47, 33 (1994).
15. G.D. Garbulsky and G. Ceder, Phys. Rev. B, 49, 6327 (1994).
16. G.D. Garbulsky and G. Ceder, Phys. Rev. B, 53, 8993 (1996).
17. A. Zunger, S.-H. Wei, L.G. Ferreira, and J.E. Bernard, Phys. Rev. Lett., 65, 353 (1990).
18. K.C. Hass, L.C. Davis, and A. Zunger, Phys. Rev. B, 42, 3757 (1990).
19. S.-H. Wei, L.G. Ferreira, J.E. Bernard, and A. Zunger, Phys. Rev. B, 42, 9622 (1990).
20. A.F. Voter and S.P. Chen, Mater. Res. Soc. Symp. Proc., 82, 175 (1988).
21. S.M. Foiles, M.I. Baskes, and M.S. Daw, Phys. Rev. B, 33, 7983 (1986).
22. S.M. Foiles, Phys. Rev. B, 49, 14930 (1994).
23. G. Moraitis and F. Gautier, J. Phys. F, 7, 1421 (1977).
24. A. Zunger, Statics and Dynamics of Alloy Phase Transformations, P.E.A. Turchi and A. Gonis, Ed., Vol. 319. NATO Advanced Study Institute, Series B: Physics, Plenum, New York (1994).
25. J.W.D. Connolly and A.R. Williams, Phys. Rev. B, 27, 5169 (1983).
26. Z.W. Lu, S.-H. Wei, A. Zunger, S. Frota-Pessoa, and L.G. Ferreira, Phys. Rev. B, 44, 512 (1991).
27. M.D. Asta, Ph.D. dissertation, University of California at Berkeley (1993).
28. Obtained from C. Wolverton, personal communication.
29. D.D. Johnson, unpublished data.
30. C. Wolverton, unpublished data.
31. F. Cardellini, F. Cleri, G. Mazzone, A. Montone, and V. Rosato, J. Mater. Res., 8, 2504 (1993).