Principles and theories of green chemistry for corrosion science and engineering: design and application

C Verma, DS Chauhan, R Aslam, P Banerjee… - Green …, 2024 - pubs.rsc.org
Given the high toxicity of inorganic inhibitors, organic substances, primarily heterocycles,
have been proven to be one of the most efficient, cost-effective, and practical alternatives …

Combined electrochemical, DFT/MD-simulation and hybrid machine learning based on ANN-ANFIS models for prediction of doxorubicin drug as corrosion inhibitor for …

FE Abeng, VC Anadebe - Computational and Theoretical Chemistry, 2023 - Elsevier
In this work, Doxorubicin drug was used as mild steel corrosion inhibitor in 0.5 MH 2 SO 4
solution. Herein, standard techniques like gravimetric, electrochemical measurement …

[HTML][HTML] Millettia aboensis leaves extract as eco-friendly corrosion inhibitor for mild steel in acidizing solution: From experimental to molecular level prediction

FE Abeng, BI Ita, ME Ikpi, VI Chukwuike, AI Ikeuba… - Results in …, 2024 - Elsevier
The development of environmentally friendly corrosion inhibitors is becoming more popular
since conventional inhibitors are poisonous and non-biodegradable. The anti-corrosive …

Combined electrochemical, atomic scale-DFT and MD simulation of Nickel based metal organic framework (Ni-MOF) as corrosion inhibitor for X65 pipeline steel in …

VC Anadebe, VI Chukwuike, KC Nayak… - Materials Chemistry and …, 2024 - Elsevier
Ni-based metal organic framework (Ni-MOF) was synthesized using nickel nitrate
hexahydrate as a central metal cation and 2 methyl imidazole as an organic linker. The …

Pharmaceuticals for materials protection: Experimental and computational studies of expired closantel drug (C22H14Cl2I2N2O2) as a potent corrosion inhibitor

MS Bejandi, MH Behroozi, MR Khalili, R Sharifi… - Journal of Industrial and …, 2024 - Elsevier
The unique molecular structure of Closantel, a pharmaceutical compound, with a high
number of heteroatoms, aromatic structures, and multiple bonds can introduce the expired …

Natural and synthetic drugs as eco-friendly and sustainable corrosion inhibitors for metals: a review

CN Njoku, TU Maduoma, W Emori, RE Odey… - Pigment & Resin …, 2024 - emerald.com
Purpose Corrosion is a major concern for many industries that use metals as structural or
functional materials, and the use of corrosion inhibitors is a widely accepted strategy to …

A comprehensive computational study of N-phenylacetamide derivatives as corrosion inhibitors for copper: insights from DFT and molecular dynamics

ZAE Caid, DB Left, A Thoume, R Kellal… - Journal of Bio-and Tribo …, 2023 - Springer
Using density functional theory (DFT) and molecular dynamics simulations, we made
predictions on the corrosion inhibition performance of N-phenylacetamide (PAA), N-(4 …

Unraveling the corrosion inhibition behavior of prinivil drug on mild steel in 1M HCl corrosive solution: insights from density functional theory, molecular dynamics, and …

A Thakur, A Kumar, O Dagdag, H Kim, A Berisha… - Frontiers in …, 2024 - frontiersin.org
The deterioration of mild steel in an acidic environment poses a significant challenge in
various industries. The emergence of effective corrosion inhibitors has drawn attention to …

[HTML][HTML] 1-Hexadecyl-3-methylimidazolium tetrachloroindate ionic liquid as corrosion inhibitor for mild steel: Insight from experimental, computational, multivariate …

NM Amadi, JO Ezeugo, CC Okoye, JI Obibuenyi… - Results in …, 2024 - Elsevier
The current study is focused on the synthesis and evaluation of 1-Hexadecyl-3-
methylimidazolium tetrachloroindate [C 16 mim][In Cl 4] based ionic liquid (IL) as a corrosion …

Surface interaction of expired Brilcure (Ticagrelor) drug on soft-cast steel in 0.5 M H2SO4 medium: Corrosion protection, surface characterizations and computational …

SD Kotabagi, RL Minagalavar, SK Rajappa… - Journal of the Taiwan …, 2024 - Elsevier
Background Soft-cast steel (SCS) is extensively used in industry but is prone to corrosion in
acidic solutions, necessitating effective protection methods. Corrosion inhibitors offer a …