Scopus İndeksli Yayınlar Koleksiyonu / Scopus Indexed Publications Collection
Permanent URI for this collectionhttps://hdl.handle.net/11147/7148
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Article Citation - WoS: 3Citation - Scopus: 4Photocatalytic and Optical Properties of Zinc Oxide Structures Prepared at Different Urea Concentrations(Serban Solacolu Foundation, 2020) Uysal, Berk; Şen, Selin; Top, AybenIn this study, ZnO samples were synthesized using zinc acetate and urea with a method containing sonication, sol-gel transition and calcination steps. Urea to zinc acetate mole ratio values were changed as 0, 0.5, 1, and 2 and corresponding calcined samples were denoted as UZ-0, UZ-0.5, UZ-1, and UZ-2, respectively. Scanning electron microscopy (SEM) images indicated globular and rod-like structures. Aspect ratios of the nanorods increased as urea to zinc acetate ratio increased from 0 to 1 whereas nanoparticles with sizes of 70 +/- 20 nm were observed for UZ-2 sample. Brunauer, Emmett and Teller (BET) surface area values of the samples varied between 9 and 25 m(2)/g and increased as initial urea amount increased. Band gap energies of the samples ranged between 3.24 and 3.29 eV. Four major peaks at about 400, 420, 480 and 530 nm with different intensities were observed in the photoluminescence (PL) spectra of the samples. All the samples removed rhodamine B by both adsorption and photodegradation. The highest visible light induced photodegradation rate was exhibited by UZ-2 sample having the highest surface area and it is attributed to superior charge separation properties of this sample under visible light.Article Citation - WoS: 21Citation - Scopus: 21Prediction of Monoclinic Single-Layer Janus Ga2tex (x = S and Se): Strong In-Plane Anisotropy(American Physical Society, 2021) Yağmurcukardeş, Mehmet; Moğulkoç, Yeşim; Akgenç, Berna; Moğulkoç Aybey; Peeters, François M.By using density functional theory (DFT) based first-principles calculations, electronic, vibrational, piezo-electric, and optical properties of monoclinic Janus single-layer Ga2TeX (X = S or Se) are investigated. The dynamical, mechanical, and thermal stability of the proposed Janus single layers are verified by means of phonon bands, stiffness tensor, and quantum molecular dynamics simulations. The calculated vibrational spectrum reveals the either pure or coupled optical phonon branches arising from Ga-Te and Ga-X atoms. In addition to the in-plane anisotropy, single-layer Janus Ga2TeX exhibits additional out-of-plane asymmetry, which leads to important consequences for its electronic and optical properties. Electronic band dispersions indicate the direct band-gap semiconducting nature of the constructed Janus structures with energy band gaps falling into visible spectrum. Moreover, while orientation-dependent linear-elastic properties of Janus single layers indicate their strong anisotropy, the calculated in-plane stiffness values reveal the ultrasoft nature of the structures. In addition, predicted piezoelectric coefficients show that while there is a strong in-plane anisotropy between piezoelectric constants along armchair (AC) and zigzag (ZZ) directions, there exists a tiny polarization along the out-of-plane direction as a result of the formation of Janus structure. The optical response to electromagnetic radiation has been also analyzed through density functional theory by considering the independent-particle approximation. Finally, the optical spectra of Janus Ga2TeX structures is investigated and it showed a shift from the ultraviolet region to the visible region. The fact that the spectrum is between these regions will allow it to be used in solar energy and many nanoelectronics applications. The predicted monoclinic single-layer Janus Ga2TeX are relevant for promising applications in optoelectronics, optical dichroism, and anisotropic nanoelasticity.