The structural and electronic properties of small osmium clusters (2-14): A density functional theory study

Chemical Physics Letters

Volumn 555, Issue , 2013, Pages 26-30

  Takahashi, Keisuke ^a   Isobe, Shigehito ^a   Ohnuki, Somei ^a  

^a HOKKAIDO UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

BASIN-HOPPING ALGORITHM; GROUND-STATE STRUCTURES; OSMIUM CLUSTER;

BINDING ENERGY; CATALYSTS; ELECTRONIC PROPERTIES; ISOMERS; MAGNETIC PROPERTIES; OSMIUM;

DENSITY FUNCTIONAL THEORY;

EID: 84871360240     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2012.10.055     Document Type: Article

References (33)

1. W. Eberhardt Surf. Sci. 500 2002 242
2. R.L. Whetten, D.M. Cox, D.J. Trevor, and A. Kaldor Phys. Rev. Lett. 54 1985 1494
3. I. Panas, J. Schüle, P. Siegbahn, and U. Wahlgren Chem. Phys. Lett. 149 1988 265
4. M. Andersson, J.L. Persson, and A. Rosén J. Phys. Chem. 100 1996 12222
5. I.M. Billas, A. Châtelain, and W.A. de Heer Science 265 1994 1682
6. R. Kodama J. Magn. Magn. Mater. 200 1999 359
7. O. Diéguez, M.M.G. Alemany, C. Rey, P. Ordejón, and L.J. Gallego Phys. Rev. B 63 2001 205407
8. I.M.L. Billas, J.A. Becker, A. Châtelain, and W.A. de Heer Phys. Rev. Lett. 71 1993 4067
9. D. Kaiming, Y. Jinlong, X. Chuanyun, and W. Kelin Phys. Rev. B 54 1996 2191
10. B.V. Reddy, S.N. Khanna, and B.I. Dunlap Phys. Rev. Lett. 70 1993 3323
11. R. Guo, and K. Balasubramanian J. Chem. Phys. 118 2003 142
12. Z. Wu, B. Han, Z. Dai, and P. Jin Chem. Phys. Lett. 403 2005 367
13. R.D. Adams, and X. Qu Organometallics 14 1995 4167
14. C.-T. Au, C.-F. Ng, and M.-S. Liao J. Catal. 185 1999 12
15. T. Zoberbier J. Am. Chem. Soc. 134 2012 3073
16. T.W. Chamberlain, T. Zoberbier, J. Biskupek, A. Botos, U. Kaiser, and A.N. Khlobystov Chem. Sci. 3 2012 1919
17. D.J. Wales, and J.P.K. Doye J. Phys. Chem. A 101 1997 5111
18. W. Zhang, L. Xiao, Y. Hirata, T. Pawluk, and L. Wang Chem. Phys. Lett. 383 2004 67
19. J. Mortensen, L. Hansen, and K. Jacobsen Phys. Rev. B 71 2005 035109
20. J. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
21. K. Takahashi, M.Sc. Thesis, Chalmers University of Technology, 2011.
22. S. Li, H. Li, J. Liu, X. Xue, Y. Tian, H. He, and Y. Jia Phys. Rev. B 76 2007 045410
23. Y.C. Bae, H. Osanai, V. Kumar, and Y. Kawazoe Mater. Trans. 46 2005 159 162
24. Z.C. Tang, Rong-bin Huang, Hong Chen, and L.S. Zheng Eur. J. Mass Spectr. 6 2000 19 22
25. F.A. Cotton, A.R. Chakravarty, D.A. Tocher, and T.A. Stephenson Inorg. Chim. Acta 87 1984 115
26. C.D. Tait, J.M. Garner, J.P. Collman, A.P. Sattelberger, and W.H. Woodruff J. Am. Chem. Soc. 111 1989 9072
27. J. Du, X. Sun, and H. Wang Int. J. Quant. Chem. 108 2008 1505
28. R.O. Jones Phys. Rev. Lett. 67 1991 224
29. J. Wang, G. Wang, and J. Zhao Phys. Rev. B 66 2002 035418
30. B. Assadollahzadeh, S. Schäfer, and P. Schwerdtfeger J. Comput. Chem. 31 2010 929
31. G.H. Guvelioglu, P. Ma, X. He, R.C. Forrey, and H. Cheng Phys. Rev. Lett. 94 2005 026103
32. F. Liu, M.R. Press, S.N. Khanna, and P. Jena Phys. Rev. B 39 1989 6914
33. B.V. Reddy, S.K. Nayak, S.N. Khanna, B.K. Rao, and P. Jena J. Phys. Chem. A 102 1998 1748