Zobrazeno 1 - 10
of 178
pro vyhledávání: '"Ellialtioglu, S."'
Autor:
Turan Büyükdinç, Damla, Kantoğlu, K. Yaprak, Kuşvuran, Şebnem, İpek, Ahmet, Karataş, Arzu, Ellialtıoğlu, Ş. Şebnem
Publikováno v:
In Applied Radiation and Isotopes December 2022 190
Publikováno v:
J. Phys. Chem. C 116, 19429 (2012)
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 supplemented with van der Waals (vdW) interactions. Our He atom diffracti
Externí odkaz:
http://arxiv.org/abs/1203.5937
Publikováno v:
Phys. Rev. B 80, 035422 (2009)
We have used density functional theory calculations based on the projector augmented wave method to investigate the electronic structure of Au-incorporated anatase TiO$_2$(001) surface. Due to the coordination with several level oxygens, Au atoms can
Externí odkaz:
http://arxiv.org/abs/0907.0599
Publikováno v:
Phys. Rev. B 79, 125418 (2009).
First-principles density functional theory calculations were carried out to determine the low energy geometries of anatase TiO$_2$(001) with Pt implants in the sublayers as substitutional and interstitial impurities as well as on the surface in the f
Externí odkaz:
http://arxiv.org/abs/0903.1362
Publikováno v:
J. Phys. Chem. C 2007, 111, 7539-7547
The systematic trends in structural and electronic properties of perylene diimide (PDI) derived dye molecules have been investigated by DFT calculations based on projector augmented wave (PAW) method including gradient corrected exchange-correlation
Externí odkaz:
http://arxiv.org/abs/0801.0316
Publikováno v:
Phys. Rev. B 72, 205415 (2005)
First-principles calculations using density functional theory based on norm-conserving pseudopotentials have been performed to investigate the Cs adsorption on the Si(001) surface for 0.5 and 1 ML coverages. We found that the saturation coverage corr
Externí odkaz:
http://arxiv.org/abs/cond-mat/0504088
Publikováno v:
Surf. Sci. 583 (2005) 119
We have investigated Rb adsorption on the Si(100) surface for 0.5 and 1 monolayer coverages using the total energy method with norm-conserving pseudopotentials. For 2$\times$1 reconstruction at 1 ML coverage symmetrized dimers are found to be energet
Externí odkaz:
http://arxiv.org/abs/cond-mat/0501349
Autor:
Ellialtıoğlu, Ş., Mete, E., Shaltaf, R., Allakhverdiev, K., Gashimzade, F., Nizametdinova, M., Orudzhev, G.
Publikováno v:
Phys. Rev. B 70, 195118 (2004)
An ab-initio pseudopotential calculation using density functional theory within the local density approximation has been performed to investigate the electronic properties of TlSe which is of chain-like crystal geometry. The energy bands and effectiv
Externí odkaz:
http://arxiv.org/abs/cond-mat/0406287
Publikováno v:
Phys. Rev. B 69, 125417 (2004)
First-principles calculations using density functional theory based on norm-conserving pseudopotentials have been performed to investigate the Mg adsorption on the Si(001) surface for 1/4, 1/2 and 1 monolayer coverages. For both 1/4 and 1/2 ML covera
Externí odkaz:
http://arxiv.org/abs/cond-mat/0308351
Publikováno v:
Phys. Rev. B 68, 035119 (2003)
First-principles density functional calculations are performed within the local density approximation to study the electronic properties of SrZrO$_3$, an insulating 4d-perovskite, in its high-temperature cubic phase, above 1400 K, as well as the gene
Externí odkaz:
http://arxiv.org/abs/cond-mat/0304703