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Öğe Experimental and theoretical characterization of Dy-doped hydroxyapatites(Springer, 2023) Isen, Fatih; Kaygili, Omer; Bulut, Niyazi; Ates, Tankut; Osmanlioglu, Fatih; Keser, Serhat; Tatar, BeyhanThe effects of adding Dy to the hydroxyapatite (HAp) structure were investigated experimentally and theoretically. The as-obtained experimental results with an increasing amount of Dy are as follows. X-ray diffraction, Raman, and Fourier transform infrared measurements verified the HAp structure for each specimen. The crystallinity, lattice parameters, lattice stress, strain, and anisotropic energy density were affected. Thermal stability and stoichiometry were not affected. It was observed that all the Dy-doped HAps have smaller crystallite size values compared to the un-doped HAp. The cell viability obtained from mouse fibroblast cell (L929) was higher than 82%, indicating all the samples were biocompatible. The theoretical findings, obtained from the density functional theory (DFT) calculations, exhibited a continuous decrease in the bandgap from 4.7109 to 3.7982 eV, an increase in the density from 3,155 to 3,189 kg m(-3), and an increase in the linear absorption coefficient.Öğe Investigation of the structural, thermal, magnetic and cell viability properties of Ce/Sr co-doped hydroxyapatites(Elsevier, 2023) Ates, Hulya Gunes; Kaygili, Omer; Bulut, Niyazi; Osmanlioglu, Fatih; Keser, Serhat; Tatar, Beyhan; Mahmood, Bahroz KareemThe present study aims to give a more detailed report on the structural, thermal, magnetic and in vitro cell viability properties of the hydroxyapatites (HAps) co-doped with Sr and Ce at different amounts. Besides these experimental analyses, this study also includes the theoretical calculation results obtained from the modeled systems for the as-prepared samples. Diamagnetic behavior was observed for all the samples, as well as their high cell compatibilities. All the samples showed a thermally stable behavior, and the mass change mechanism and specific heat capacity were affected by the amount of the codopants. The bandgap value and linear absorption coefficient varied with the amount of both co-dopants. (c) 2023 Elsevier B.V. All rights reserved.Öğe Theoretical and experimental investigation of the effects of Pr dopant on the electronic band structure, thermal, structural, in vitro biocompatibility of Er-based hydroxyapatites(Elsevier, 2023) Ahmed, Lana Omar; Bulut, Niyazi; Osmanlioglu, Fatih; Tatar, Beyhan; Kebiroglu, Hanifi; Ates, Tankut; Koytepe, SuleymanPr and Er co-doped hydroxyapatites (HAps) have undergone their first theoretical and experimental re-search. Pr content was changed in 0.13 percent increments from 0.13 to 0.78 percent. Er content was kept constant at 0.39 at.%. Theoretical results demonstrated an increase in the density from 3.154 to 3.179 g cm -3, as well as steady decreases in the bandgap from 4.1739 to 4.0618 eV. X-ray diffraction (XRD) pat-terns point out that all the samples consist of the single phase of the HAp. The crystallinity decreased steadily with adding of Pr. Pr-content has a considerable impact on all the XRD-related parameters, ther-mal behavior and morphology. The cell viability was affected by the co-dopant content, and this value was found to be higher than 83% for all the samples. (c) 2023 Elsevier B.V. All rights reserved.