STRUCTURE AND MAGNETIC PROPERTIES OF Co12X(X = Ni, Ag, Pt, Au) CLUSTERS
2007 ◽
Vol 21
(30)
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pp. 5091-5098
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Keyword(s):
The ground state structures of Co 12 X ( X = Ni , Ag , Pt , Au ) clusters are obtained by a genetic algorithm with a Gupta-like many-body potential, and further optimized using the density functional theory with generalized gradient approximation. The structures of Co 12 X have a slightly distorted icosahedral pattern. The X atom is on the surface for the most stable configuration. Their total magnetic moments are 0μ B , 3μ B , 21μ B , and 22μ B , respectively. The reasons for the reduction of magnetism of Co 12 X are discussed in detail.
2012 ◽
Vol 542-543
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pp. 1418-1421
2016 ◽
Vol 24
(04)
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pp. 1750049
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2007 ◽
Vol 567-568
◽
pp. 77-80
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2012 ◽
Vol 535-537
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pp. 1291-1294
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