An examination of the effectiveness of the expired drug isoprinosine in preventing aluminum corrosion in alkaline solutions using both computational and experimental techniques.

A now-expired medication called isoprinosine was examined in NaOH (0.50 M) solutions as a potential novel inhibitor of aluminum corrosion. The inhibitory effectiveness of the isoprinosine compounds was examined utilizing different electrochemical tests (open circuit potential OCP, potentiodynamic polarization and electrochemical impedance spectroscopy EIS), surface examination and quantum calculations. Increases in isoprinosine concentration were seen to increase the inhibitory efficacy. It was discovered that the inhibitory action, which results in the inhibition of charge and mass transfer and protects the aluminum against harmful ions, was brought on by isoprinosine molecules adhering to the aluminum surface. Additionally, the surface morphology of Al dissolved in a 0.50 M NaOH solution without and with the existence of an isoprinosine molecule was analyzed using SEM/EDX and AFM techniques. Utilizing the optimized geometric parameters of the ground state molecules, FMO simulations and additional studies were executed successfully utilizing the density functional theory (DFT/B3LYP/6-311++G(d,p)). Based on the expected energies for the molecular carriers of charge, HOMO and LUMO. Calculations are also done for the AIM charges, Fukui functions, AIM charges, and excitation energies. Furthermore, molecular dynamic was simulated to explore the corrosion inhibition efficiency and mechanism of inhibition. The computational results are in the same agreement with experimental results, showing that isoprinosine can inhibit the corrosion of aluminum in 0.5 M NaOH.

Expression of concern: Impact of some pyrrolidinium ionic liquids on copper dissolution behavior in acidic environment: experimental, morphological and theoretical insights.

Expression of concern for 'Impact of some pyrrolidinium ionic liquids on copper dissolution behavior in acidic environment: experimental, morphological and theoretical insights' by Emad E. El-Katori and Ashraf S. Abousalem, RSC Adv., 2019, 9, 20760-20777, https://doi.org/10.1039/C9RA03603B.

Electrochemical Investigation of C-Steel Corrosion Inhibition, In Silico, and Sulfate-Reducing Bacteria Investigations Using Pyrazole Derivatives.

The inhibitory impact of the two synthesized pyrazole derivatives (3 and 4) toward metallic and microbial corrosion was investigated. Using open circuit potential, potentiodynamic polarization, and electrochemical impedance spectroscopy, it was possible to determine their ability to prevent the corrosion of C-steel in 1 M HCl, which was significantly enhanced with increasing concentration (ex. 93%). They act as mixed-type inhibitors, according to polarization curves. The compounds under investigation were adsorbed on a C-steel surface in 1 M HCl following the Langmuir isotherm model. The double-layer capacitance was decreased, and the charge transfer resistance (Rct) was raised due to the examined inhibitors' adsorption. Investigating changes in the surface morphology and confirming the corrosion inhibition mechanism are done using scanning electron microscopy. Density functional theory calculations and Monte Carlo simulations were also conducted to show the adsorption affinity of the understudied compounds over the steel substrate in neutral and protonated forms. Furthermore, the antimicrobial performance of the two synthesized pyrazoles against sulfate-reducing bacteria was evaluated, and the recorded inhibition efficiency was 100%. The current research shows important developments in producing highly effective anticorrosion and antimicrobial pyrazole derivatives.

Impact of some pyrrolidinium ionic liquids on copper dissolution behavior in acidic environment: experimental, morphological and theoretical insights.

The inhibitive and adsorption activity of some pyrrolidinium ionic liquids (ILs) for the dissolution of copper in 1 M HNO3 solution was tested using chemical methods such as weight loss and electrochemical techniques; potentiodynamic polarization, electrochemical impedance spectroscopy (EIS) and electrical frequency modulation (EFM) techniques. The results indicated that the ionic liquids under investigation exhibited promising corrosion inhibitory performance in 1 M HNO3 and their efficiencies reached up to 85% at 0.05 mM. Also, an enhancement in the inhibition efficiency (% IE) accompanied the increase in inhibitor concentration. The polarization measurements suggested that these ionic liquid inhibitors act as mixed-type inhibitors. The adsorption of the ionic liquid inhibitors on the copper surface obey the Langmuir adsorption isotherm. Thermodynamic parameters were calculated and discussed. The surface morphology of the copper surface was examined using different techniques. Correlation between the calculated % IE from experiments and some quantum chemical parameters was established.