| 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 |
| Density functional theory (DFT) | X-ray diffraction (XRD) | ZnO |
| 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 |
| Sayı | 1 |
| 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 |
| Atıf Sayıları | |
| WoS | 13 |
| SCOPUS | 13 |
| Google Scholar | 15 |
