Determination of electronic characteristics of tetrahydro pyrimidine derivatives and investigation of usability as anti-corrosion

E Akbaş, M Okay, E Ergan, BÇ Akbaş - International Journal of …, 2021 - dergipark.org.tr
Corrosion of metallic structures is a serious problem in most industries worldwide. This
problem can be controlled by the addition of chemicals capable of adsorption onto the metal …

Calculation of usability as anti-corrosion of pyrimidine-type bases by density functional theory

E Akbaş, H Kahraman, BÇ Akbaş - International Journal of …, 2022 - dergipark.org.tr
Corrosion of metals is an important problem in many industries. This problem can be
reduced by coating the metal surface. With this application, the metal can be isolated from …

[PDF][PDF] Synthesis, characterization and theoretical studies of novel pyrimidine derivatives as potential corrosion inhibitors

E Akbas, E Yildiz, A Erdogan - Journal of the Serbian Chemical …, 2020 - shd-pub.org.rs
{Synthesis, characterization and electrochemical properties of novel pyrimidine derivatives as
potential corrosion inhibitors ag Page 1 J. Serb. Chem. Soc. 85 (4) 481–492 (2020) UDC …

[PDF][PDF] Synthesis, Characterization, and DFT Calculation of Some New Pyrimidine Derivatives and Theoretical Studies on the Corrosion Inhibition Performance

E Akbas, A Ruzgar, A Cagla, S Ertan - Iranian Journal of Chemistry and …, 2022 - ijcce.ac.ir
In this study, 5-benzoyl-6-phenyl-4-(4-(trifluoromethoxy) phenyl)-1, 2, 3, 4-
tetrahydroxypyrimidine (1); 5-benzoyl-6-phenyl-4-(4-(trifluoromethoxy) phenyl)-1, 2, 3, 4 …

Theoretical Studies via DFT Calculation of Pyrimidine Derivatives as Potential Corrosion Inhibitor

E Ergan - Journal of the Institute of Science and Technology, 2021 - dergipark.org.tr
In this work, the corrosion prevention behaviors of pyrimidine derivatives (1-12) were
investigated by theoretical quantum chemical calculation. Quantum chemical parameters …

Quantum Chemical Investigation on 2, 5-Dimethoxyphenethylamine Derivatives as Effective Corrosion Inhibitors

P Acar Bozkurt, M Yaşar, NM Kaleli… - Available at SSRN … - papers.ssrn.com
Quantum chemical calculations were performed using density functional theory (DFT) to
investigate the correlation between the molecular structures of some 2, 5 …

[PDF][PDF] Quantum chemical studies on corrosion inhibition of 1, 3-thiazine derivatives for mild steel in acidic media: DFT approach

O Sikemi, OA Kolawole, S Banjo - Manila Journal of Science, 2017 - researchgate.net
Quantum chemical calculations via B3LYP/631G (dp) level were performed on 1, 3-Thiazine
derivatives used as corrosion inhibitors for mild steel in acidic media. The calculated …

Exploring the Potential of Quantum Chemical Calculations for Synthesized Quinazoline Derivatives as Superior Corrosion Inhibitors in Acidic Environment

OHR Al-Jeilawi, HN Al-Ani, A Al-Zahra… - Physical Chemistry …, 2024 - physchemres.org
Hydrochloric acid (HCl) is a substance that is frequently utilized in industrial operations for
important tasks such as chemical cleaning and pickling metallic surfaces. Therefore, the …

[PDF][PDF] Theoretical evaluation of pyrazolo [3, 4-d] pyrimidine-thiones analogues as corrosion inhibitors for carbon steel in hydrochloric acid

OA Kolawolea, LB Marya, OE Opeyemib… - Int. J. Modern …, 2018 - researchgate.net
Quantum chemical calculations via B3LYP/6-31G (d, p) level was carried out on pyrazolo [3,
4-d] pyrimidine-thiones derivatives and these were used as corrosion inhibitors. The …

Potansiyel Korozyon İnhibitörü Olarak Pirimidin Türevlerinin DFT Hesaplaması ile Teorik Çalışmalar.

E ERGAN - Journal of The Institute of Science & Technology …, 2021 - search.ebscohost.com
In this work, the corrosion prevention behaviors of pyrimidine derivatives (1-12) were
investigated by theoretical quantum chemical calculation. Quantum chemical parameters …