Mixed-metal effects on ultra-incompressible metal diborides: Density functional computations

Chemical Physics Letters

Volumn 494, Issue 1-3, 2010, Pages 31-36

  Lin, Fei ^a   Wu, Kechen ^a   He, Jiangang ^a   Sa, Rongjian ^a   Li, Qiaohong ^a   Wei, Yongqin ^a  

^a FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ANTIBONDING; BONDING STRENGTH; DENSITY FUNCTIONAL COMPUTATIONS; DIBORIDES; ELASTIC PROPERTIES; METAL BORIDE; METAL INTERACTIONS; PURE METALS; RELATIVISTIC EFFECTS; SUPERHARD MATERIAL;

BORIDES; BORON; ELASTICITY; IRIDIUM; METALS; OSMIUM;

ELASTIC MODULI;

EID: 77955925990     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2010.05.067     Document Type: Article

References (48)

1. R.B. Kaner, J.J. Gilman, and S.H. Tolbert Science 308 2005 1268
2. J.C. Crowhurst, A.F. Goncharov, B. Sadigh, C.L. Evans, P.G. Morrall, J.L. Ferreira, and A.J. Nelson Science 311 2006 1275
3. A.F. Young, C. Sanloup, E. Gregoryanz, S. Scandolo, R.J. Hemley, and H.K. Mao Phys. Rev. Lett. 96 2006 155501
4. D. Aberg, B. Sadigh, J.C. Crowhurst, and A.F. Goncharov Phys. Rev. Lett. 100 2008 095501
5. H. Wang, Q. Li, Y.W. Li, Y. Xu, T. Cui, A.R. Oganov, and Y.M. Ma Phys. Rev. B 79 2009 132109
6. E.J. Zhao, and Z.J. Wu Comput. Mater. Sci. 44 2008 531
7. E.J. Zhao, J.P. Wang, J. Meng, and Z.J. Wu Comput. Mater. Sci. 47 2010 1064
8. L. Song, and Y.X. Wang Phys. Status Solidi B 247 2010 54
9. W.J. Zhao, X. Bin, and Y.X. Wang Phys. Status Solidi RRL 3 2009 272
10. R.W. Cumberland, M.B. Weinberger, J.J. Gilman, S.M. Clark, S.H. Tolbert, and R.B. Kaner J. Am. Chem. Soc. 127 2005 7264
11. H.-Y. Chung, M.B. Weinberger, J.B. Levine, A. Kavner, J.-M. Yang, S.H. Tolbert, and R.B. Kaner Science 316 2007 436
12. J. Yang, H. Sun, and C.F. Chen J. Am. Chem. Soc. 130 2008 7200
13. H.Y. Gou, L. Hou, J.W. Zhang, H. Li, G.F. Sun, and F.M. Gao Appl. Phys. Lett. 88 2006 221904
14. Y.X. Wang Appl. Phys. Lett. 91 2007 101904
15. R.F. Zhang, S. Veprek, and A.S. Argon Appl. Phys. Lett. 91 2007 201914
16. H.-Y. Chung, M.B. Weinberger, J.-M. Yang, S.H. Tolbert, and R.B. Kaner Appl. Phys. Lett. 92 2008 261904
17. X.-Q. Chen, C.L. Fu, M. Krcmar, and G.S. Painter Phys. Rev. Lett. 100 2008 196403
18. S. Chiodo, H.J. Gotsis, N. Russo, and E. Sicilia Chem. Phys. Lett. 425 2006 311
19. J. Wang, and Y.-J. Wang J. Appl. Phys. 105 2009 083539
20. Z.Y. Chen, H.J. Xiang, J.L. Yang, J.G. Hou, and Q.S. Zhu Phys. Rev. B 74 2006 012102
21. X.F. Hao, Y.H. Xu, Z.J. Wu, D.F. Zhou, X.J. Liu, and J. Meng J. Alloys Compd. 453 2008 413
22. X.F. Hao, Y.H. Xu, Z.J. Wu, D.F. Zhou, X.J. Liu, X.Q. Cao, and J. Meng Phys. Rev. B 74 2006 224112
23. Y.C. Liang, and B. Zhang Phys. Rev. B 76 2007 132101
24. W. Zhou, H. Wu, and T. Yildirim Phys. Rev. B 76 2007 184113
25. M. Hebbache, L. Stuparevic, and D. Zivkovic Solid State Commun. 139 2006 227
26. M.R. Koehler, V. Keppens, B.C. Sales, R.Y. Jin, and D. Mandrus J. Phys. D: Appl. Phys. 42 2009 095414
27. J.B. Levine, S.H. Tolbert, and R.B. Kaner Adv. Funct. Mater. 19 2009 3519
28. M. Wang, Y.W. Li, T. Cui, Y.M. Ma, and G.T. Zou Appl. Phys. Lett. 93 2008 101905
29. D. Tzeli, and A. Mavridis J. Chem. Phys. 128 2008 034309
30. Y.C. Liang, J.Z. Zhao, and B. Zhang Solid State Commun. 146 2008 450
31. H.Y. Gou, L. Hou, J.W. Zhang, and F.M. Gao Appl. Phys. Lett. 92 2008 241901
32. S. Ono, T. Kikegawa, and Y. Ohishi Solid State Commun. 133 2005 55
33. C. Paduani J. Phys.: Condens. Matter 20 2008 225014
34. K. Nakamura, and M. Yashima Mater. Sci. Eng. B 148 2008 69
35. Y.C. Liang, C. Li, W.L. Guo, and W.Q. Zhang Phys. Rev. B 79 2009 024111
36. Q.F. Gu, G. Krauss, and W. Steurer Adv. Mater. 20 2008 3620
37. M.B. Weinberger Chem. Mater. 21 2009 1915
38. S. La Placa, and B. Post Acta Crystallogr. 15 1962 97
39. B. Aronson Acta Chem. Scand. 17 1963 2036
40. G. Kresse, and D. Joubert Phys. Rev. B 59 1999 1758
41. J.P. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
42. J. Hafner J. Comput. Chem. 29 2008 2044
43. R. Hill Proc. Phys. Soc. London 65 1952 349
44. M. Born Proc. Cambridge Philos. Soc. 36 1940 160
45. M. Born, K. Huang, Dynamical Theory of Crystal Lattices, Clarendon Oxford, 1956.
46. H.T. Mcskimin, and P. Andreatch J. Appl. Phys. 43 1972 985
47. F.Z. Ren, Y.X. Wang, and G.B. Zhang Chin. Phys. Lett. 26 2009 016102
48. P. Vajeeston, P. Ravindran, C. Ravi, and R. Asokamani Phys. Rev. B 63 2001 045115