Electronic structure, phase stability, and chemical ordering of the ω phase in a Ti3 Al2 X (X=Nb,V) alloy

Physical Review B - Condensed Matter and Materials Physics

Volumn 76, Issue 17, 2007, Pages

  Sanati, M ^a,b   West, D ^a   Albers, R C ^b  

^a TEXAS TECH UNIVERSITY   (United States)

^b LOS ALAMOS NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 35848944345     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.76.174101     Document Type: Article

References (36)

1. Proceedings of the International Symposium on Intermetallic Compounds, edited by, O. Izumi, (JIM Publications, Sendai, Japan, 1991).
2. L. A. Bendersky, W. J. Boettinger, B. P. Burton, and F. S. Biancaniello, Acta Metall. Mater. AMATEB 0956-7151 10.1016/0956-7151(90)90165-D 38, 931 (1990).
3. F. A. Sadi and C. Servant, Philos. Mag. A PMAADG 0141-8610 80, 639 (2000).
4. F. A. Sadi and C. Servant, Z. Metallkd. ZEMTAE 0044-3093 91, 504 (2000).
5. C. B. Shoemaker, D. P. Shoemaker, and L. A. Bendersky, Acta Crystallogr., Sect. C: Cryst. Struct. Commun. ACSCEE 0108-2701 46, 374 (1990).
6. T. H. Yu and C. H. Koo, Mater. Sci. Eng., A MSAPE3 0921-5093 239-240, 694 (1997).
7. R. Strychor, J. C. Williams, and W. A. Soffa, Metall. Trans. A MTTABN 0360-2133 19, 225 (1988).
8. C. P. Chang and M. H. Loretto, Philos. Mag. A PMAADG 0141-8610 63, 389 (1991).
9. T. Ahmed and H. M. Flower, Mater. Sci. Eng., A MSAPE3 0921-5093 152, 31 (1992).
10. P. Tsakiropoulos and G. Shao, Mater. Sci. Eng., A MSAPE3 0921-5093 375-377, 201 (2004).
11. G. Shao and P. Tsakiropoulos, Mater. Sci. Eng., A MSAPE3 0921-5093 329-331, 914 (2002).
12. G. Shao, P. Tsakiropoulos, and A. P. Miodownik, Mater. Sci. Eng., A MSAPE3 0921-5093 10.1016/0921-5093(96)10379-8 216, 1 (1996).
13. G. Shao, A. P. Miodownik, and P. Tsakiropoulos, Philos. Mag. A PMAADG 0141-8610 71, 1389 (1995).
14. S. K. Sikka, Y. K. Vohra, and R. Chidambaran, Prog. Mater. Sci. PRMSAQ 0079-6425 10.1016/0079-6425(82)90002-0 27, 245 (1982).
15. D. Banerjee, T. K. Nandy, and A. K. Gogia, Scr. Metall. SCRMBU 0036-9748 10.1016/0036-9748(87)90367-X 21, 597 (1987).
16. Computer code VASP, at http://cms.mpi.univie.ac.at/vasp
17. G. Kresse and J. Hafner, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.47.558 47, 558 (1993).
18. G. Kresse and J. Furthmüller, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.11169 54, 11169 (1996).
19. G. Kresse and D. Joubert, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.1758 59, 1758 (1999).
20. D. P. Ordejón, E. Artacho, and J. M. Soler, Int. J. Quantum Chem. IJQCB2 0020-7608 10.1002/(SICI)1097-461X(1997)65:5<453::AID-QUA9>3.0.CO;2- V 65, 453 (1997).
21. E. Artacho, D. Sánchez-Portal, P. Ordejón, A. García, and J. M. Soler, Phys. Status Solidi B PSSBBD 0370-1972 10.1002/(SICI)1521-3951(199909)215:1<809::AID-PSSB809>3.0.CO;2-0 215, 809 (1999).
22. J. P. Perdew, in Electronic Structure of Solids'91, edited by, P. Ziesche, and, H. Eschring, (Akademie-Verlag, Berlin, 1991), p. 11.
23. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865 77, 3865 (1996).
24. D. Vanderbilt, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.41.7892 41, 7892 (1990).
25. G. Kresse and J. Furthmüller, Comput. Mater. Sci. CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0 6, 15 (1996).
26. H. J. Monkhorst and J. D. Pack, Phys. Rev. B PLRBAQ 0556-2805 10.1103/PhysRevB.13.5188 13, 5188 (1976).
27. N. Troullier and J. L. Martins, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.43.1993 43, 1993 (1991).
28. O. F. Sankey and D. J. Niklewski, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.40.3979 40, 3979 (1989);
29. O. F. Sankey, D. J. Niklewski, D. A. Drabold, and J. D. Dow, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.41.12750 41, 12750 (1990).
30. A. A. Demkov, J. Ortega, O. F. Sankey, and M. P. Grumbach, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.52.1618 52, 1618 (1995).
31. M. Sanati, R. C. Albers, and F. J. Pinski, J. Phys. C JPSOAW 0022-3719 13, 5387 (2001).
32. S. Diplas, J. F. Watts, P. Tsakiropoulos, G. Shao, G. Beamson, and J. A. D. Matthew, Surf. Interface Anal. SIANDQ 0142-2421 31, 734 (2001).
33. D. J. Singh, in Intermetallic Compounds: Principles and Practice, edited by, J. H. Westbrook, and, R. L. Fleischer, (Wiley, New York, 1995), Vol. 1, p. 127.
34. Q. M. Hu, R. Yang, D. S. Xu, Y. L. Hao, D. Li, and W. T. Wu, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.68.054102 68, 054102 (2003).
35. M. Enomoto and H. Harada, Metall. Trans. A MTTABN 0360-2133 20, 649 (1989).
36. D. L. Moffat and U. R. Kattner, Metall. Trans. A MTTABN 0360-2133 19, 2389 (1988).