Anticorrosive Effects of Some Thiophene Derivatives Against the Corrosion of Iron: A Computational Study

It is known that iron is one of the most widely used metals in industrial production. In this work, the inhibition performances of three thiophene derivatives on the corrosion of iron were investigated in the light of several theoretical approaches. In the section including DFT calculations, several...

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Bibliographic Details
Main Authors: Lei Guo, Zaki S. Safi, Savas Kaya, Wei Shi, Burak Tüzün, Nail Altunay, Cemal Kaya
Format: Article
Language:English
Published: Frontiers Media S.A. 2018-05-01
Series:Frontiers in Chemistry
Subjects:
DFT
Online Access:http://journal.frontiersin.org/article/10.3389/fchem.2018.00155/full