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Evaluating electronic structure of quinazolinone and pyrimidinone molecules for its corrosion inhibition effectiveness on target specific mild steel in the acidic medium: A combined DFT and MD simulation study
Organic Chemistry
Materials Chemistry
Civil And Structural Engineering
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Authors
Sourav Saha
,
Manilal Murmu
Naresh Murmu
+1 authors
,
Priyabrata Banerjee
Journal
Journal of Molecular Liquids
Published
Oct 1, 2016
DOI
10.1016/j.molliq.2016.09.110
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