The Quantum Chemical Calculations of Serine Therionine and Glutamine
Yazarlar (5)
Prof. Dr. Fatma Kandemirli Kastamonu Üniversitesi, Türkiye
Prof. Dr. Murat Saracoglu Erciyes Üniversitesi, Türkiye
Mohammed A. Amin
Taif University, Suudi Arabistan
Taif University, Suudi Arabistan
Murat A. Basaran Akdeniz Üniversitesi, Türkiye
Doç. Dr. Can Doğan VURDU Kastamonu Üniversitesi, Türkiye
| Makale Türü |
Özgün Makale
(SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
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| Dergi Adı | International Journal of Electrochemical Science | ||
| Dergi ISSN | 1452-3981 Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 04-2014 |
| Kabul Tarihi | – | Yayınlanma Tarihi | 01-07-2014 |
| Cilt / Sayı / Sayfa | 9 / 7 / 3819–3827 | DOI | 10.1016/s1452-3981(23)08053-7 |
| Makale Linki | https://doi.org/10.1016/s1452-3981(23)08053-7 | ||
| Özet |
| An examination of quantum chemical and corrosion inhibition studies for three serine (Ser), therionine (Thr) and glutamine (Glu) which had been tested as corrosion safe inhibitors for cold rolled steel (CRS) in 1.0 M HCl solutions at different temperatures (283-333 K) were made to see if any clear links exist between them. The Genetic Function Approximation Method has been used for QSAR study. The correlation between inhibition efficiency and descriptor variables obtained from the quantum chemical calculation using B3LYP/6-311G(d,p), B3LYP/6-311++G(2d,2p), MP2/6-311G(d,p), and CBS-APNO methods. |
| Anahtar Kelimeler |
| Corrosion inhibition | Genetic function approximation method | Glutamine | Serine | Therionine |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 18 |
| Scopus | 22 |
| Google Scholar | 38 |