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Browsing Elektronik ve Haberleşme Mühendisliği Bölümü Yayın Koleksiyonu by Subject "Cluster"

Browsing Elektronik ve Haberleşme Mühendisliği Bölümü Yayın Koleksiyonu by Subject "Cluster"

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  • A density functional study of small Li-B and Li-B-H clusters 
    Yıldırım, Erdem Kamil; Güvenç, Büşra (Pergamon-Elsevier Science Ltd, 2009-06)
    In this work we present the results of a detailed theoretical research for the small Li(n)B(m) clusters and their hydrogen storage properties by means of density functional theory. All calculations were performed by using ...
  • Density functional study of AlBn clusters for n=1-14 
    Böyükata, Mustafa; Güvenç, Büşra (Elsevier Science S A, 2011-03-17)
    Density functional theory (DFT) B3LYP at 6-311++G(d,p) level is employed to optimize the structures of AlBn (n = 1-14) microclusters. Analysis of the energetic and structural stability of these clusters and their various ...
  • Density functional study of physical and chemical properties of nano size Boron Clusters: B-n (n=13-20) 
    Atış, Murat; Özdoğan, Cem; Güvenç, Büşra (Chinese Physical Soc, 2009-08)
    Boron is an element that has ability to build strong and highly directional bonds with boron itself. As a result, boron atoms form diverse structural motifs, ultimately can yield distinct nano structures, such as planar, ...
  • MD study of energetics, melting and isomerization of aluminum microclusters 
    Böyükata, Mustafa; Güvenç, Ziya B. (Springer, 2006-09)
    Voter and Chen version of an Embedded Atom Model has been applied to study the locally stable structures, energies, melting, isomerization and growth patterns of small aluminum clusters, Al(n), in the size range of n = 2 ...
  • Structure and dynamical properties of Au-N, N=12-14 clusters: Molecular dynamics simulation 
    Yıldırım, E. K.; Atış, Murat; Güvenç, Ziya B. (World Scientific Publ CO PTE LTD, 2005-01)
    Using molecular dynamics and thermal quenching methods on the basis of Voter-Chen version of the embedded-atom method, we have studied the melting behavior of Au-N (N = 12, 13, 14) clusters. This behavior is described in ...