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Keywords = Fukui indices
Number of Articles: 3
Theoretical Investigations on Thiadiazole Derivatives as Corrosion Inhibitors on Mild Steel
Volume 6, Issue 2 , April 2023, , Pages 141-154
Abstract
Experimental methods have been employed to elucidate the corrosion inhibition mechanism, but they are often expensive and time-consuming, necessitating the search for more alternatives. ... Read More
Quinazoline Derivatives as Corrosion Inhibitors on Aluminium Metal Surface: A Theoretical Study
Volume 6, Issue 1 , January 2023, , Pages 71-84
Abstract
Quantum chemical calculations and molecular dynamics simulation techniques were used to assess the corrosion inhibition potential of the compound qiunazoline (QZN) and two of its derivatives, ... Read More
Corrosion Inhibitive Potentials of Some Amino Acid Derivatives of 1,4-Naphthoquinone–DFT Calculations
Volume 5, Issue 4 , October 2022, , Pages 263-270