Theoretical evaluation of corrosion inhibition performance of some pyrazine derivatives
325 citations recorded by the source corpus.
Subfields: Materials Chemistry, Molecular Biology, Organic Chemistry
View Paper: https://www.semanticscholar.org/paper/d39c2004ffcb969ce5d086da8cdcf31a6d395230
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In Materials Chemistry
Citations in the corpus
- Enhanced corrosion resistance of mild steel in 1 M HCl solution by trace amount of 2-phenyl-benzothiazole derivatives: Experimental, quantum chemical calculations and molecular dynamics (MD) simulation studies (2017, methodology): “Molecular dynamics (MD) simulation Recently, MD simulations have been employed to investigate the adsorption behavior of the inhibitor molecule on the metallic surfaces [17, 20, 34, 61], MD simulation can reasonably predict”