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- Title
147 Atomlu Co-Pd Nanoalaşımlarının Erime Dinamiği.
- Authors
Garip, Ali Kemal
- Abstract
A theoretical study has been made of 147 atom Co-Pd nanoalloy clusters in gas phase, with the interatomic interactions modelled by Gupta many-body potential. Basin Hopping algorithm has been used to find the lowest energy structures for some compositions of ComPdn (m+n=147) clusters. Icosahedron geometry has beenidentified for all compositions (m=0, 1, 13, 55, 92, 134, 147). Co13Pd134 nanoalloy has the highest melting point among for all these compositions. It's also investigated the melting dynamics including core and shell layers of Co-Pd clusters in this study. It's concluded that melting begins from outermost shell generally.
- Publication
Karaelmas Science & Engineering Journal / Karaelmas Fen ve Mühendislik Dergisi, 2016, Vol 6, Issue 2, p369
- ISSN
2146-4987
- Publication type
Article