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An experimental and theoretical investigation of the structure of synthesized ZnO powder       
Yazarlar
Ömer Kayğılı
Fırat Üniversitesi, Türkiye
Tankut Ateş
Serhat Keser
Fırat Üniversitesi, Türkiye
Öğr. Gör. Dr. Cahit ÖREK
Kastamonu Üniversitesi, Türkiye
Bayram Gündüz
Muş Alparslan Üniversitesi, Türkiye
Turgay Seçkin
İnönü Üniversitesi, Türkiye
Niyazi Bulut
Fırat Üniversitesi, Türkiye
Luis Banares
İsmail Ercan
Özet
ZnO powder has been synthesized, characterized experimentally and its theoretical modeling carried out by density functional theory (DFT). The experimental and theoretical results were compared with each other and with the available data in the literature. A detailed crystal structure analysis was carried out using X-ray diffraction (XRD) data. Experimental and theoretical FTIR analysis, energy gap and density of states and electronic band structure calculations have been done for a complete characterization of the material. The surface morphology has been investigated by scanning electron microscopy (SEM) and energy dispersive X-ray (EDX) spectroscopy. It has been found that the electron excitation of ZnO can occur most probably at the Γ-Γ point, where the energy gap has the lowest value between the valance and conduction bands.
Anahtar Kelimeler
ZnO,X-ray diffraction (XRD),Density functional theory (DFT)
Makale Türü Özgün Makale
Makale Alt Türü SSCI, AHCI, SCI, SCI-Exp dergilerinde yayımlanan tam makale
Dergi Adı Chemical Physics
Dergi ISSN 0301-0104
Dergi Tarandığı Indeksler SCI-Expanded
Dergi Grubu Q2
Makale Dili İngilizce
Basım Tarihi 09-2018
Cilt No 513
Sayfalar 273 / 279
Doi Numarası 10.1016/j.chemphys.2018.08.021
Makale Linki http://dx.doi.org/10.1016/j.chemphys.2018.08.021
BM Sürdürülebilir Kalkınma Amaçları
Atıf Sayıları
WoS 13
SCOPUS 13
Google Scholar 15
An experimental and theoretical investigation of the structure of synthesized ZnO powder

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