DSpace@Çankaya

Yazar "Çankaya Ünversitesi, Mühendislik Fakültesi, Elektronik ve Haberleşme Mühendisliği Bölümü" için Mühendislik Fakültesi listeleme

Yazar "Çankaya Ünversitesi, Mühendislik Fakültesi, Elektronik ve Haberleşme Mühendisliği Bölümü" için Mühendislik Fakültesi listeleme

Sırala: Sıra: Sonuçlar:

  • Dft Study of Al Doped Cage B12hn Clusters 
    Böyükata, Mustafa; Güvenç, Ziya B. (Pergamon-Elsevier Science LTD, 2011-07)
    Density Functional Theory (DFT) with B3LYP/6-311++g** level has been performed to investigate the electronic structures of cage B12Hn for up to n <= 12 and AlB12Hn for up to n <= 13. Moreover, the computations has been ...
  • Dynamics of the D(2)+Ni(100) collision system: Analysis of the reactive and inelastic channels 
    Böyükata, Mustafa; Güvenç, Büşra; Jackson, Bret; Jellinek, Johanna (Wiley-Blackwell, 2001)
    The reactive and scattering channels of the D(2)(v, j) + Ni(100) collision system are studied using quasiclassical molecular dynamics simulations. The interaction between the D(2) and the atoms of the surface is modeled ...
  • Eley-Rideal and hot atom reactions between hydrogen atoms on Ni(100): electronic structure and quasiclassical studies 
    Güvenç, Ziya B.; Sha, Xianwei; Jackson, Bret (Amer Inst Physics, 2001-11-15)
    The reactions of gas-phase H (or D) atoms with D (or H) atoms adsorbed onto a Ni(100) surface are studied. Electronic structure calculations based on density functional theory are used to examine the interaction of H atoms ...
  • Structure and reactivity of Ni(n) (n=7-14, 19) clusters 
    Böyükata, Mustafa; Güvenç, Ziya B.; Özçelik, Süleyman; Durmuş, Perihan; Jellinek, Julius (Wiley-Blackwell, 2001)
    Results of a computer simulation study of Ni(n) (n = 7-14, 19) clusters, their structures, energetics, and reactivity with a D(2) molecule are presented. The clusters are described by an embedded atom potential, whereas ...