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Electronic structure of large modified nickel nanoclusters
A combined method of quantum-chemical semiempirical approach MNDO and molecular dynamics with atomic potentials was used while studying the growth of large nanoclusters of nickel. Geometry and electronic structure of Ni₄₈₅ were studied as well as a series of similar surface (111) substituted (by Pd,...
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Main Authors: | , , |
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Format: | Article |
Language: | English |
Published: |
Інститут фізики конденсованих систем НАН України
2006
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Series: | Condensed Matter Physics |
Online Access: | http://dspace.nbuv.gov.ua/handle/123456789/121449 |
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