Density functional theory and molecular dynamics simulation study on corrosion inhibition performance of mild steel by mercapto-quinoline Schiff base corrosion inhibitor

Title
Density functional theory and molecular dynamics simulation study on corrosion inhibition performance of mild steel by mercapto-quinoline Schiff base corrosion inhibitor
Authors
Keywords
Mild steel, Schiff base inhibitors, Acid inhibition, Quantum chemical calculations, Molecular dynamics simulation
Journal
Publisher
Elsevier BV
Online
2014-10-30
DOI
10.1016/j.physe.2014.10.035

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