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cemal kaya
cemal kaya
Adresse e-mail validée de cumhuriyet.edu.tr
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Theoretical insight into an empirical rule about organic corrosion inhibitors containing nitrogen, oxygen, and sulfur atoms
L Guo, IB Obot, X Zheng, X Shen, Y Qiang, S Kaya, C Kaya
Applied surface science 406, 301-306, 2017
3872017
Determination of corrosion inhibition effects of amino acids: quantum chemical and molecular dynamic simulation study
S Kaya, B Tüzün, C Kaya, IB Obot
Journal of the Taiwan Institute of Chemical Engineers 58, 528-535, 2016
2832016
A computational study on corrosion inhibition performances of novel quinoline derivatives against the corrosion of iron
Ş Erdoğan, ZS Safi, S Kaya, DÖ Işın, L Guo, C Kaya
Journal of Molecular Structure 1134, 751-761, 2017
2652017
Quantum chemical and molecular dynamic simulation studies for the prediction of inhibition efficiencies of some piperidine derivatives on the corrosion of iron
S Kaya, L Guo, C Kaya, B Tüzün, IB Obot, R Touir, N Islam
Journal of the Taiwan Institute of Chemical Engineers 65, 522-529, 2016
2082016
Density Functional Theory (DFT) modeling and Monte Carlo simulation assessment of inhibition performance of some carbohydrazide Schiff bases for steel corrosion
IB Obot, S Kaya, C Kaya, B Tüzün
Physica E: Low-dimensional Systems and Nanostructures 80, 82-90, 2016
1892016
Anticorrosive effects of some thiophene derivatives against the corrosion of iron: a computational study
L Guo, ZS Safi, S Kaya, W Shi, B Tüzün, N Altunay, C Kaya
Frontiers in chemistry 6, 155, 2018
1812018
A new equation for calculation of chemical hardness of groups and molecules
S Kaya, C Kaya
Molecular Physics 113 (11), 1311-1319, 2015
1652015
Quantum chemical and molecular dynamics simulation studies on inhibition performances of some thiazole and thiadiazole derivatives against corrosion of iron
S Kaya, C Kaya, L Guo, F Kandemirli, B Tüzün, İ Uğurlu, LH Madkour, ...
Journal of Molecular Liquids 219, 497-504, 2016
1412016
A new method for calculation of molecular hardness: a theoretical study
S Kaya, C Kaya
computational and theoretical chemistry 1060, 66-70, 2015
1362015
Theoretical evaluation of some benzotriazole and phospono derivatives as aluminum corrosion inhibitors: DFT and molecular dynamics simulation approaches
S Kaya, P Banerjee, SK Saha, B Tüzün, C Kaya
RSC advances 6 (78), 74550-74559, 2016
1342016
Quantum chemical calculations, molecular dynamic (MD) simulations and experimental studies of using some azo dyes as corrosion inhibitors for iron. Part 2: Bis–azo dye derivatives
LH Madkour, S Kaya, L Guo, C Kaya
Journal of Molecular Structure 1163, 397-417, 2018
1252018
Experimental and theoretical studies for mild steel corrosion inhibition in 1.0 M HCl by three new quinoxalinone derivatives
A Tazouti, M Galai, R Touir, ME Touhami, A Zarrouk, Y Ramli, ...
Journal of Molecular Liquids 221, 815-832, 2016
1062016
A simple method for the calculation of lattice energies of inorganic ionic crystals based on the chemical hardness
S Kaya, C Kaya
Inorganic chemistry 54 (17), 8207-8213, 2015
1042015
Quantum chemical calculations, molecular dynamics simulation and experimental studies of using some azo dyes as corrosion inhibitors for iron. Part 1: Mono-azo dye derivatives
LH Madkour, S Kaya, C Kaya, L Guo
Journal of the Taiwan Institute of Chemical Engineers 68, 461-480, 2016
972016
A new equation based on ionization energies and electron affinities of atoms for calculating of group electronegativity
S Kaya, C Kaya
Computational and Theoretical Chemistry 1052, 42-46, 2015
942015
Theoretical evaluation of triazine derivatives as steel corrosion inhibitors: DFT and Monte Carlo simulation approaches
IB Obot, S Kaya, C Kaya, B Tüzün
Research on Chemical Intermediates 42, 4963-4983, 2016
842016
Investigation of DNA–RNA molecules for the efficiency and activity of corrosion inhibition by DFT and molecular docking
B Tüzün, C Kaya
Journal of Bio-and Tribo-Corrosion 4 (4), 69, 2018
562018
Maximum hardness and minimum polarizability principles through lattice energies of ionic compounds
S Kaya, C Kaya, N Islam
Physica B: Condensed Matter 485, 60-66, 2016
552016
Conceptual density functional theoretical investigation of the corrosion inhibition efficiencies of some molecules containing mercapto (-SH) group
S Kaya, B Tüzün, C Kaya
Current Physical Chemistry 7 (2), 147-153, 2017
332017
Resorcinarene‐functionalised imidazolium salts as ligand precursors for palladium‐catalysed Suzuki–Miyaura cross‐couplings
N Şahin, D Sémeril, E Brenner, D Matt, İ Özdemir, C Kaya, L Toupet
ChemCatChem 5 (5), 1116-1125, 2013
322013
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