TY - JOUR T1 - Theoretical Study of Khellin Derivatives as Corrosion Inhibitors Based on Density Functional Theory (DFT) AU - Khoiriah, Khoiriah AU - Marni, Lidia Gusfi AU - Emriadi, Emriadi AU - Imelda, Imelda AU - Darajat, Syukri PY - 2024 DA - December Y2 - 2024 DO - 10.33435/tcandtc.1382029 JF - Turkish Computational and Theoretical Chemistry JO - Turkish Comp Theo Chem (TC&TC) PB - Koray SAYIN WT - DergiPark SN - 2587-1722 SP - 36 EP - 47 VL - 8 IS - 4 LA - en AB - Theoretical studies of Khellin in the presence of electron donor and electron with-drawing groups as a corrosion inhibitor are investigated using the B3LYP/6-31G (d, p) theory level with Gaussian software. 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