Searching for the optimum structures of alloy nanoclusters (Articolo in rivista)

Type
Label
  • Searching for the optimum structures of alloy nanoclusters (Articolo in rivista) (literal)
Anno
  • 2008-01-01T00:00:00+01:00 (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi
  • 10.1039/b709000e (literal)
Alternative label
  • Ferrando, R; Fortunelli, A; Johnston, RL (2008)
    Searching for the optimum structures of alloy nanoclusters
    in PCCP. Physical chemistry chemical physics (Print); The Royal Society of Chemistry, Cambridge (Regno Unito)
    (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori
  • Ferrando, R; Fortunelli, A; Johnston, RL (literal)
Pagina inizio
  • 640 (literal)
Pagina fine
  • 649 (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#altreInformazioni
  • 52 citations until 31/12/2011 (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume
  • 10 (literal)
Rivista
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#pagineTotali
  • 10 (literal)
Note
  • ISI Web of Science (WOS) (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni
  • \"[Ferrando, Riccardo] Univ Genoa, Dipartimento Fis, INFM, IMEM CNR, I-16146 Genoa, Italy; [Fortunelli, Alessandro] IPCF, CNR, I-56124 Pisa, Italy; [Johnston, Roy L.] Univ Birmingham, Sch Chem, Birmingham B15 2TT, W Midlands, England (literal)
Titolo
  • Searching for the optimum structures of alloy nanoclusters (literal)
Abstract
  • Recent advances in computational methods for searching for the most stable structures of alloy nanoparticles are reviewed. A methodology based on extensive global optimization searches within an empirical potential model in conjunction with structure recognition algorithms and subsequent density-functional local relaxation of the lowest-energy structures pertaining to each different structural basin is proposed. Applications to different systems, including Cu-Ag, Cu-Au, Ni-Ag, Co-Ag, Co-Au, Ni-Au and Pd-Pt clusters, are presented. (literal)
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