Nanomaterials for Sustainable Energy in Hydrogen-Fuel Cell: Functionalization and Characterization of Carbon Nano-Semiconductors with Silicon, Germanium, Tin or Lead through Density Functional Theory Study
Yazarlar (2)
Dr. Öğr. Üyesi Fatemeh MOLLAAMIN Kastamonu Üniversitesi, Türkiye
Prof. Dr. Majıd MONAJJEMI Islamic Azad University, Central Tehran Branch, İran
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Russian Journal of Physical Chemistry B | ||
| Dergi ISSN | 1990-7931 Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | SCI-Exp, SCOPUS, CCR Database, Chemistry Server Reaction Center, Curation, Current Contents Physical Chemical & Earth Sciences, Essential Science Indicators, Reaction Citation Index, Reference Master, Sophia | ||
| Makale Dili | İngilizce | Basım Tarihi | 04-2024 |
| Cilt / Sayı / Sayfa | 18 / 2 / 607–623 | DOI | 10.1134/S1990793124020271 |
| Makale Linki | https://link.springer.com/article/10.1134/S1990793124020271 | ||
| UAK Araştırma Alanları |
Fen Bilimleri ve Matematik
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| Özet |
| Hydrogen fuel is a promising route to remark on the energy and environmental challenges facing the world today. Therefore, hydrogen storage has become enhancing essential for progressing cleaner and more sustainable technologies. Recent research has recognized metal and metalloid hydrides as a promising alternative that might suggest some benefits over compressed storage. In this work, a profound study on the adsorption of hydrogen by nanocone carbides of main group elements including Si, Ge, Sn and Pb has been done including both geometrical and electronic properties using density functional calculations. The effect of substituting silicon (Si) in silicon carbide by germanium (Ge), tin (Sn) or lead (Pb) elements on the geometrical structure and H atom adsorption behavior were investigated. The results show that when Si atoms are replaced by a Ge, Sn or Pb atoms, the hydrogen adsorption energy … |
| Anahtar Kelimeler |
| energy storage | nanomaterial carbides, adsorption, density functional theory |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 42 |
| Scopus | 58 |
| Google Scholar | 64 |