Corrosion Inhibition Potential of Thiosemicarbazide Derivatives on ALuminium: Insight from Molecular Modelling and QSARs Approaches
The potentials of six thiosemicarbazide derivatives towards corrosion inhibition were investigated theoretically using density functional theory (DFT) and quantitative structural-activity relationships (QSARs) methods. Their performance as corrosion inhibitors were evaluated using their calculated...
Main Authors: | , |
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Format: | Article |
Language: | English |
Published: |
Nigerian Society of Physical Sciences
2023-01-01
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Series: | Journal of Nigerian Society of Physical Sciences |
Subjects: | |
Online Access: | https://journal.nsps.org.ng/index.php/jnsps/article/view/915 |