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Static and dynamical isomerization of Cu(38) cluster
The lowest-energy geometrical and electronic structures of Cu(38) cluster are investigated by density-functional calculations combined with a genetic algorithm based on a many body semi-empirical interatomic potential, the traditional FCC-truncated Octahedron (OH) and an incomplete-Mackay icosahedro...
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| Udgivet i: | Sci Rep |
|---|---|
| Main Authors: | , , , , , , |
| Format: | Artigo |
| Sprog: | Inglês |
| Udgivet: |
Nature Publishing Group UK
2019
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| Fag: | |
| Online adgang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6527573/ https://ncbi.nlm.nih.gov/pubmed/31110223 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-019-44055-z |
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