ArticleACS omega2022
Corrosion Inhibition Properties of Phenyl Phthalimide Derivatives against Carbon Steel in the Acidic Medium: DFT, MP2, and Monte Carlo Simulation Studies.
Article in ACS omega, 2022. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 5 papers.
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Who cites it
5 citing papers in PubMed.
- Surface and Electrochemical Investigation of a Novel Isoxazolone Inhibitor for Carbon Steel Corrosion: Adsorption and Inhibition Mechanism.ACS omega · 2026Article
- From the Problem of Corrosion to Green Solutions: The Role of Biosurfactants as Anti-Corrosion Agents.Materials (Basel, Switzerland) · 2026Review
- Dual-function ethoxylated cationic surfactant for pipeline corrosion and sulfate-reducing bacteria control: electrochemical and theoretical studies.Scientific reports · 2025Article
- A data-driven QSPR model for screening organic corrosion inhibitors for carbon steel using machine learning techniques.RSC advances · 2024Article
- DFT Study on Corrosion Inhibition by Tetrazole Derivatives: Investigation of the Substitution Effect.ACS omega · 2023Article
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Authors and funding
5 authors.
Funding
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Abstract
The effectiveness of phenyl phthalimide and its derivatives at preventing corrosion of carbon steel has been tested experimentally using gravimetric and electrochemical measurements. However, experimental studies have not thoroughly explained the structural patterns and coating mechanisms of phenyl phthalimide and its derivatives during corrosion inhibition. In this study, the density functional theory (DFT), ab initio MP2, and Monte Carlo simulation are applied to study phenyl phthalimide (PP) and its derivatives as corrosion inhibitors of carbon steel. The geometry, quantum parameters, and reactive site of the inhibitors were determined by DFT and ab initio MP2 methods. The real environment conditions of corrosion inhibition in the solution phase can be replicated by the Monte Carlo simulation. The corrosion inhibition efficiency of phthalimide derivatives is PP-OCH
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