109 citations · 529 across the 26 of their papers we have counts for
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Common surface structures of graphene and Au(111) : The effect of rotational angle on adsorption and electronic properties
Merve Yortanlı, Ersen Mete
Graphene adsorption on Au(111) surface was explored to identify their common surface structures by means of van der Waals corrected density functional theory calculations. The alig…
Double Perovskite Structure Induced by Co Addition to PbTiO : Insights from DFT and Experimental Solid State NMR Spectroscopy
Ersen Mete, Selda Odabaşı, Haiyan Mao +5
The effects of Co addition on the chemical and electronic structure of PbTiO were explored both by theory and through experiment. Cobalt was incorporated to PbTiO during so…
Screened Coulomb Hybrid Density Functional Investigation of Oxygen Point Defects on ZnO Nanowires
Veysel Çelik, Ersen Mete
In this study, oxygen vacancies and adatoms have been considered on the surface of both hexagonal and triangular ZnO nanowires. Their effect on the electronic structure and optical…
Range separated hybrid exchange-correlation functional analyses of W and/or N(S) (co)doped anatase TiO_2
Veysel Çelik, Ersen Mete
Electronic properties and atomic structures of W, N, S, W/N, and W/S dopings of anatase TiO_2 have been systematically investigated using the density functional theory (DFT). The e…
Influence of steps on the tilting and adsorption dynamics of ordered Pn films on vicinal Ag(111) surfaces
E. Mete, I. Demiroglu, E. Albayrak +3
Here we present a structural study of pentacene (Pn) thin films on vicinal Ag(111) surfaces by He atom diffraction measurements and density functional theory (DFT) calculations sup…
DFT study of noble metal impurities on TiO_2(110)
Ersen Mete, Oğuz Gülseren, Şinasi Ellialtıoğlu
Atomic and electronic structures of TiO_2(110) surface with possible adsorptional, substitutional and interstitial Au or Pt elemental impurities at full and one-sixth monolayer con…