Magnetism and Substrate Effects of Mn3 Clusters on Cu(111), Pd(111) and Ne(111)
Received Date:
April 20, 2011
Published Date:
April 30, 2011
Abstract
The magnetic moments of Mn3 clusters on Cu(111), Pd(111) and Ne(111) non−magnetic substrates are investigated using first-principles methods based on density-functional theory. The calculated results reveal that the Mn magnetic moments are closely associated with the geometric structures of the clusters and the interparticle separation. Moreover, it is found that the magnetic moments of Mn3 clusters on three different Cu(111), Pd(111) and Ne(111) substrates are quite different. Meanwhile, the orbit annihilating induced from the crystalline field of the substrates and the electron transfer from the substrate atoms to Mn3 adatoms are used to explain the different changes of the average magnetic moments of Mn3 .
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References
[1]
Jamneala T et al 2001 Phys. Rev. Lett. 87 256804
[2]
Zhang L P et al 1999 Phys. Rev. B 59 5837
[3]
Lau J T et al 2002 Phys. Rev. Lett. 89 057201
[4]
Gambardella P et al 2003 Science 300 1130
[5]
Pick S et al 2004 Phys. Rev. B 70 224419
[6]
Jürgen Hafner et al 2007 Phys. Rev. B 76 094420
[7]
Wang X C, Zhu Z Z 2007 Chin. Phys. Lett. 24 172
[8]
Kuang A et al 2009 Appl. Surf. Sci. 255 6624
[9]
Nayak S K et al 1998 J. Phys.: Condens. Matter 10 10863
[10]
Pederson M R et al 1998 Phys. Rev. B 58 5632
[11]
Nayak S K and Jena P 1998 Chem. Phys. Lett. 289 473
[12]
Bobadova-Parvanova P et al 2003 Phys. Rev. A 67 061202(R)
[13]
Mejía-López J et al 2006 Phys. Rev. B 74 140405(R)
[14]
Bergman A et al 2007 Phys. Rev. B 75 224425
[15]
Payne M C et al 1992 Rev. Mod. Phys. 64 1045
[16]
Kresse G et al 1996 Comput. Mater. Sci. 6 15
[17]
Perdew J P et al 1992 Phys. Rev. B 46 6671
[18]
Wu Q Y et al 2007 Solid State Commun. 142 242
[19]
Xu G G et al 2008 Phys. Rev. B 78 115420
[20]
Xu G G et al 2009 J. Appl. Phys. 106 043708
[21]
Methfessel M and Paxton A T 1989 Phys. Rev. B 40 3616
[22]
Press W H, Flannery B P et al 1986 New Numerical Recipes (New York: Cambridge University)
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About This Article
Cite this article:
ZHONG Ke-Hua, WENG Zhen-Zhen, FENG Qian, YANG Yan-Min, HUANG Zhi-Gao. Magnetism and Substrate Effects of Mn
3 Clusters on Cu(111), Pd(111) and Ne(111)[J].
Chin. Phys. Lett. , 2011, 28(5): 057501.
DOI: 10.1088/0256-307X/28/5/057501
ZHONG Ke-Hua, WENG Zhen-Zhen, FENG Qian, YANG Yan-Min, HUANG Zhi-Gao. Magnetism and Substrate Effects of Mn3 Clusters on Cu(111), Pd(111) and Ne(111)[J]. Chin. Phys. Lett. , 2011, 28(5): 057501. DOI: 10.1088/0256-307X/28/5/057501