CaXH3 (X = Mn, Fe, Co) perovskite‐type hydrides for hydrogen storage applications
Yazarlar (5)
Gokhan Surucu Kırşehir Ahi Evran Üniversitesi, Türkiye
Aysenur Gencer Karamanoğlu Mehmetbey Üniversitesi, Türkiye
Prof. Dr. Abdullah CANDAN Kırşehir Ahi Evran Üniversitesi, Türkiye
Hasan H. Gullu Atilim University, Türkiye
Mehmet Isik Atilim University, Türkiye
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | International Journal of Energy Research | ||
| Dergi ISSN | 0363-907X Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 03-2020 |
| Kabul Tarihi | 26-11-2019 | Yayınlanma Tarihi | 12-12-2019 |
| Cilt / Sayı / Sayfa | 44 / 3 / 2345–2354 | DOI | 10.1002/er.5062 |
| Makale Linki | https://hdl.handle.net/11492/3263 | ||
| Özet |
| Hydrogen storage is one of the attractive research interests in recent years due to the advantages of hydrogen to be used as energy source. The studies on hydrogen storage applications focus mainly on investigation of hydrogen storage capabilities of newly introduced compounds. The present paper aims at characterization of CaXH3 (X: Mn, Fe, or Co) perovskite‐type hydrides for the first time to understand their potential contribution to the hydrogen storage applications. CaXH3 compounds have been investigated by density functional theory studies to reveal their various characteristics and hydrogen storage properties. CaXH3 compounds have been optimized in cubic crystal structure and the lattice constants of studied compounds have been obtained as 3.60, 3.50, and 3.48 Å for X: Mn, Fe, and Co compounds, respectively. The optimized structures have negative formation enthalpies pointing out that studied … |
| Anahtar Kelimeler |
| density functional theory | dynamical properties | electronic properties | hydrogen storage properties | mechanical properties | perovskite-type hydrides |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Google Scholar | 179 |
| Scopus | 127 |