| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Journal of Molecular Structure (Q2) | ||
| Dergi ISSN | 0022-2860 Dergi Bilgileri (2024) | ||
| Dergi Tarandığı Indeksler | SCI-Exp, SCOPUS, CCR Database, Chemistry Server Reaction Center, Curation, Current Contents Physical Chemical & Earth Sciences, Essential Science Indicators, Pdf2xml, Pdf2xml, Reaction Citation Index, Reference Master, Sophia | ||
| Makale Dili | İngilizce | Basım Tarihi | 03-2024 |
| Kabul Tarihi | – | Yayınlanma Tarihi | 01-03-2024 |
| Cilt / Sayı / Sayfa | 1300 / 1 / 137214–0 | DOI | 10.1016/j.molstruc.2023.137214 |
| Makale Linki | https://doi.org/10.1016/j.molstruc.2023.137214 | ||
| UAK Araştırma Alanları |
Fen Bilimleri ve Matematik
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| Özet |
| Gallium nitride nanocage (GaN_NC) can select toxic heavy metals from water. Therefore, it has been found a selective competition for metal cations in the GaN_NC. The electromagnetic and thermodynamic attributes of heavy metals cations trapped GaN_NC was depicted by material modeling. The data displays those heavy metals cations-trapped in the GaN_NC system are resistant materials, with the most firm adsorption zone in the center of the cage. Furthermore, charge transfer from GaN_NC to the heavy metals cations demonstrates clear n-type adsorbing manner. The encapsulation of heavy metals cations occurs via chemisorption. In this article, it was observed the behavior of trapping of main group cations of Cr3+, Co2+, Cu2+, Ni2+, Pb2+ and As3+ by GaN_NC for sensing the water metal cations. The nature of covalent features for these complexes has represented the analogous energy amount and … |
| Anahtar Kelimeler |
| Gallium nitride | Molecular modeling | Nanomaterial | Water contaminant |
| Atıf Sayıları | |
| Web of Science | 35 |
| Scopus | 45 |
| Google Scholar | 57 |
| Dergi Adı | Journal of Molecular Structure |
| Kısa Adı | J MOL STRUCT |
| Yayıncı | ELSEVIER |
| Açık Erişim | Hayır |
| ISSN | 0022-2860 |
| E-ISSN | 1872-8014 |
| Wos Quartile | Q2 |
| Scopus Quartile | Q2 |
| Tarandığı Indeksler | SCIE , Scopus |
| WoS Kategoriler | CHEMISTRY, PHYSICAL |
| Scopus Kategoriler | ANALYTICAL CHEMISTRY | INORGANIC CHEMISTRY | ORGANIC CHEMISTRY | SPECTROSCOPY |