Atomic structures and magnetic behavior of Mn clusters

Physical Review B - Condensed Matter and Materials Physics

Volumn 66, Issue 6, 2002, Pages 644121-644126

  Briere, Tina M ^a   Sluiter, Marcel H F ^a   Kumar, Vijay ^a   Kawazoe, Yoshiyuki ^a  

^a TOHOKU UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

FERROMAGNETIC MATERIAL; MANGANESE DERIVATIVE;

AB INITIO CALCULATION; ARTICLE; ELECTRONICS; ENERGY; GEOMETRY; MAGNETIC FIELD; STRUCTURE ANALYSIS; TEMPERATURE DEPENDENCE;

EID: 0036696986     PISSN: 01631829     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevB.66.064412     Document Type: Article

References (17)

1. V. Kumar, K. Esfarjani, and Y. Kawazoe, in Clusters and Nanomaterials, edited by Y. Kawazoe, T. Kondow, and K. Ohno, Springer Series in Cluster Physics (Springer-Verlag, Heidelberg, 2001), p. 9.
2. A. Arrott and B. R. Coles, J. Appl. Phys. 32, 51S (1961).
3. M. R. Pederson, F. Reuse, and S. N. Khanna, Phys. Rev. B 58, 5632 (1998).
4. S. K. Nayak, B. K. Rao, and P. Jena, J. Phys.: Condens. Matter 10, 10 863 (1998).
5. N. Desmarais, F. A. Reuse, and S. N. Khanna, J. Chem. Phys. 112, 5576 (2000), and references therein.
6. M. B. Knickelbein, Phys. Rev. Lett. 86, 5255 (2001).
7. G. Kresse and J. Furthmüller, Comput. Mater. Sci. 6, 15 (1996); D. Vanderbilt, Phys. Rev. B 41, 7892 (1990).
8. G. Kresse and J. Furthmüller, Comput. Mater. Sci. 6, 15 (1996); D. Vanderbilt, Phys. Rev. B 41, 7892 (1990).
9. J. P. Perdew and Y. Wang, Phys. Rev. B 45, 13 244 (1992).
10. We obtained a bond length of 2.60 Å and a binding energy of 0.325 eV/atom using the supercell method, which compares well with the earlier result of 2.61 Å and 0.315 eV/atom given in Ref. 5.
11. 19 were briefly reported in T. M. Briere, M. H. F. Sluiter, V. Kumar, and Y. Kawazoe, Mater. Trans., JIM 43, 424 (2002).
12. Q. Wang, Q. Sun, J.-Z. Yu, B.-L. Gu, Y. Kawazoe, and Y. Hashi, Phys. Rev. A 62, 063203 (2000).
13. V. Kumar and Y. Kawazoe, Phys. Rev. B 63, 075410 (2001).
14. S. K. Nayak, M. Noojien, and P. Jena, J. Phys. Chem. 103, 9853 (1999).
15. M. Moseler, H. Häkkinen, R. N. Barnett, and U. Landman, Phys. Rev. Lett. 86, 2545 (2001).
16. V. Kumar and Y. Kawazoe (unpublished).
17. C. Kohl and G. F. Bertsch, Phys. Rev. B 60, 4205 (1999).