Structure and magnetism of small Gd and Fe nanoclusters: LDA + U calculations

Solid State Communications

Volumn 149, Issue 45-46, 2009, Pages 2058-2060

  Kim, Gunn ^a   Park, Yongjin ^b   Han, Myung Joon ^a,c   Yu, Jaejun ^a   Heo, Chaejeong ^b   Lee, Young Hee ^b  

^a Seoul National University   (South Korea)

^b Sungkyunkwan University   (South Korea)

^c UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

C. Nanocluster; D. Binding energy; D. Magnetic moments

Indexed keywords

BULK COUNTERPART; C. NANOCLUSTER; D. BINDING ENERGY; D. MAGNETIC MOMENTS; DENSITY-FUNCTIONAL APPROACH; FE NANOCLUSTERS; FERROMAGNETIC MOMENTS; LDA + U; MAGNETIC CHARACTERISTIC; METAL NANOCLUSTERS; SPIN CONFIGURATIONS; SPIN-DOWN; SPIN-UP; TETRAMERS;

BINDING ENERGY; BINDING SITES; FERROMAGNETIC MATERIALS; FERROMAGNETISM; GADOLINIUM; MAGNETIC MOMENTS; NUCLEAR ENERGY; OLIGOMERS; POTENTIAL ENERGY; SPIN DYNAMICS; WAVE FUNCTIONS;

NANOCLUSTERS;

EID: 70349804503     PISSN: 00381098     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ssc.2009.08.022     Document Type: Article

References (33)

1. Frangioni J.V. Nat. Biotechnol. 24 (2006) 909
2. Woods M., Woessner D.E., and Sherry A.D. Chem. Soc. Rev. 35 (2006) 500
3. Lauffer R.B. Chem. Rev. 87 (1987) 901
4. Caravan P., Ellison J.J., McMurry T.J., and Lauffer R.B. Chem. Rev. 99 (1999) 2293
5. Aime S., Barge A., Cabella C., Crich S.G., and Gianolio E. Curr. Pharm. Biotechnol. 5 (2004) 509
6. Weissleder R., and Papisov M. Rev. Magn. Reson. Med. 4 (1992) 1
7. Rollmann G., Herper H.C., and Entel P. J. Phys. Chem. A 110 (2006) 10799
8. Lee K., Callaway J., and Dhar S. Phys. Rev. B 30 (1984) 1724
9. Castro M., and Salahub D.R. Phys. Rev. B 47 (1993) 10955
10. Chen J.L., Wang C.S., Jackson K.A., and Pederson M.R. Phys. Rev. B 44 (1991) 6558
11. Oda T., Pasquarello A., and Car R. Phys. Rev. Lett. 80 (1998) 3622
12. Hashimoto A., Yorimitsu H., Ajima K., Suenaga K., Isobe H., Miyawaki J., Yudasaka M., Iijima S., and Nakamura E. Proc. Natl. Acad. Sci. USA 101 (2004) 8527
13. Hifumi H., Yamaoka S., Tanimoto A., Citterio D., and Suzuki K. J. Am. Chem. Soc. 128 (2006) 15090
14. Barden C.J., Rienstra-Kiracofe J.C., and Schaefer III H.F. J. Chem. Phys. 113 (2000) 690
15. Anisimov V.I., Aryasetiawan F., and Lichtenstein A.I. J. Phys.: Condens. Matter 9 (1997) 767
16. Han M.J., Ozaki T., and Yu J. Phys. Rev. B 73 (2006) 045110
17. Pastor G.M., Hirsch R., and Mühlschlegel B. Phys. Rev. Lett. 72 (1994) 3879
18. Harmon B.N., Antropov V.P., Liechtenstein A.I., Solovyev I.V., and Anisimov V.I. J. Phys. Chem. Solids 56 (1995) 1521
19. M.J. Han, T. Ozaki, J. Yu, (unpublished)
20. Punkkinen M.P.J., Kokko K., Hergert W., and Vayrynen I.J. J. Phys.: Condens. Matter 11 (1999) 2341
21. Bandyopadhyay A., Velev J., Butler W.H., Sarker S.K., and Bengone O. Phys. Rev. B 69 (2004) 174429
22. Pastor G.M., Dorantes-Dávila J., and Bennemann K.H. Phys. Rev. B 40 (1989) 7642
23. Kulik H.J., Cococcioni M., Scherlis D.A., and Marzari N. Phys. Rev. Lett. 97 (2006) 103001
24. Hubner O., and Sauer J. Chem. Phys. Lett. 358 (2002) 442
25. Troullier N., and Martins J.L. Phys. Rev. B 43 (1991) 1993
26. Louie S.G., Froyen S., and Cohen M.L. Phys. Rev. B 26 (1982) 1738
27. Ozaki T. Phys. Rev. B 67 (2003) 155108
28. Koelling D.D., and Harmon B.N. J. Phys. C: Solid State Phys. 10 (1977) 3107
29. Roeland L.W., Cock G.J., Muller F.A., Moleman A.C., McEwen K.A., Jordan R.G., and Jones D.W. J. Phys. F: Met. Phys. 5 (1975) L233
30. Van Zee R.J., Lee S., and Weltner Jr. W. J. Chem. Phys. 100 (1994) 4010
31. Purdum H., Montano P.A., and Shenoy G.K. Phys. Rev. B 25 (1982) 4412
32. Lian L., Su C.-X., and Armentrout P.B. J. Chem. Phys. 97 (1992) 4072
33. Haskel D., Srajer G., Lang J.C., Pollmann J., Nelson C.S., Jiang J.S., and Bader S.D. Phys. Rev. Lett. 87 (2001) 207201