The stability and elastic constants of X2Ni3Si (X=Ti, Mo and W): The novel ternary metal silicides

Physica B: Condensed Matter

Volumn 404, Issue 12-13, 2009, Pages 1701-1704

  Zhou, C T ^a,b   Xiao, B ^a,b   Feng, J ^a   Chen, J C ^a   Zhou, R ^a   Xing, J D ^b   Li, Y F ^b  

^a BEIJING UNIVERSITY OF POSTS AND TELECOMMUNICATIONS   (China)

^b XI'AN JIAOTONG UNIVERSITY   (China)

Author keywords

Ab initio; Debye temperature; Hardness; Mechanical properties; Nickel alloys

Indexed keywords

AB-INITIO; BULK MODULUS; CHEMICAL BONDINGS; FIRST-PRINCIPLES CALCULATIONS; FORMATION ENTHALPIES; HEAT CAPACITIES; LAVES PHASIS; METAL SILICIDES; THERMODYNAMICALLY STABLES;

CHEMICAL BONDS; DEBYE TEMPERATURE; ELASTIC MODULI; HARDNESS; MECHANICAL PROPERTIES; MOLYBDENUM; NICKEL; NICKEL ALLOYS; SILICIDES;

ELASTIC CONSTANTS;

EID: 67349116016     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2009.02.007     Document Type: Article

References (28)

1. Sun Z., Zhou J., Music D., Ahuja R., and Schneider J.M. Scripta Mater. 54 (2006) 105
2. Hu C.F., Li F.Z., Zhang J., Wang J.M., Wang J.Y., and Zhou Y.C. Scripta Mater. 57 (2007) 893
3. Schneider J.M., Sigumonrong D.P., Music D., Walter C., Emmerlich J., Iskandar R., and Mayer J. Scripta Mater. 57 (2007) 1137
4. Wang J.Y., Wang J.M., Zhou Y.C., Lin Z.J., and Hu C.F. Scripta Mater. 58 (2008) 1043
5. Wang J.M., Wang J.Y., Zhou Y.C., and Hu C.F. Acta Mater. 56 (2008) 1511
6. Lu X.D., and Wang H.M. Appl. Surface Sci. 245 (2005) 346
7. Cai L.X., and Wang H.M. Appl. Surface Sci. 215 (2004) 501
8. Xiao B., Feng J., Zhou C.T., Xing J.D., Xie X.J., and Chen Y.H. Chem. Phys. Lett. 459 (2008) 129
9. Wang H.M., Luan D.Y., and Zhang L.Y. Scripta Mater. 48 (2003) 1179
10. Xu Y.W., and Wang H.M. J. Alloys Comp. 457 (2008) 239
11. Kohn W. Rev. Modern Phys. 71 (1999) 01694
12. Hohenberg P., and Kohn W. Phys. Rev. B 136 (1964) 864
13. Kohn W., and Sham L.J. Phys. Rev. A 137 (1965) 1697
14. Kohn W., and Sham L.J. Phys. Rev. A 140 (1965) 1133
15. Medeiros S.K., Albuquerque E.L., Maia Jr. F.F., Caetano E.W.S., and Freire V.N. Chem. Phys. Lett. 435 (2007) 59
16. Milman V., Winkler B., White J.A., Pickard C.J., Payne M.C., Akhmatskaya E.V., and Nobes R.H. Quantum Chem. 77 (2000) 895
17. Segall M.D., Lindan P.J.D., Probert M.J., Pickard C.J., Hasnip P.J., Clark S.J., and Payne M.C. J. Phys. Condens. Matter. 14 (2002) 2717
18. Perdew J.P., Burke K., and Wang Y. Phys. Rev. B 54 (1996) 16533
19. Monkhorst H.J., and Pack J.D. Phys. Rev. B. 135 (1976) 188
20. Ching W.Y., Mo S.D., Ouyang L.Z., Rulis P., and Yoshiya M. J. Amer. Ceramic Soc. 85 (2002) 75
21. Letsoalo T., and Lowther J.E. Physica B 403 (2008) 2760
22. Zhang X., Luo X., Han J., Li J., and Han W. Comput. Mater. Sci. 44 (2008) 411
23. Gilman J.J., Cumberland R.W., and Kaner R.B. Internat. J. Refractory Metals Hard Mater. 24 (2006) 1
24. Gao F.M., He J.L., Wu E.D., Liu S.M., Yu D.L., and Tian Y.J. Phys. Rev. Lett. 91 (2003) 015502
25. Liao T., Wang J.Y., and Zhou Y.C. Phys. Rev. B. 73 (2006) 214109
26. Lofland S.E., Hettinger J.D., Harrell K., Finkel P., Gupta S., Barsoum M.W., and Hug G. Appl. Phys. Lett. 84 (2008) 508
27. Maachoua A., Amranib B., and Driz M. Physica B 388 (2007) 384
28. Lofland S.E., Hettinger J.D., Meehan T., Bryan A., Gupta S., Barsoum M.W., and Hug G. Phys. Rev. B 74 (2006) 174501