Extensive theoretical study of corrosion inhibition efficiency of some pyrimidine derivatives on iron and the proposal of new inhibitor

Published 2019 View Full Article

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Title
Extensive theoretical study of corrosion inhibition efficiency of some pyrimidine derivatives on iron and the proposal of new inhibitor
Authors
Keywords
Corrosion inhibition, Pyrimidine, Bader analysis, Density functional theory, CI-NEB
Journal
JOURNAL OF MOLECULAR LIQUIDS
Volume 284, Issue -, Pages 225-231
Publisher
Elsevier BV
Online
2019-04-04
DOI
10.1016/j.molliq.2019.04.009

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