Investigations on eco-friendly corrosion inhibitors for mild steel in acid environment: Electrochemical, DFT and Monte Carlo Simulation approach
Sign Up to like & getrecommendations! Published in 2020 at "Colloids and Surfaces A: Physicochemical and Engineering Aspects"
DOI: 10.1016/j.colsurfa.2020.124881
Abstract: Abstract Corrosion is one of the challenging problems faced by most of the industries. Corrosion inhibitors are required to overcome the corrosion problem in these industries. Although a large number of organic corrosion inhibitors are… read more here.
Keywords: mild steel; dft monte; eco friendly; corrosion inhibitors ... See more keywords
DFT and Monte Carlo simulations of the intermetallic compound MnZnSb
Sign Up to like & getrecommendations! Published in 2024 at "Molecular Physics"
DOI: 10.1080/00268976.2024.2427238
Abstract: The present work aims to investigate the structural, magnetic and electronic properties of ternary intermetallic MnZnSb using density functional theory (DFT) and Monte Carlo simulation (MCs). The obtained ground state results reveal that MnZnSb is… read more here.
Keywords: carlo simulations; dft monte; monte carlo; mnznsb ... See more keywords
New Benzohydrazide Derivative as Corrosion Inhibitor for Carbon Steel in a 1.0 M HCl Solution: Electrochemical, DFT and Monte Carlo Simulation Studies
Sign Up to like & getrecommendations! Published in 2019 at "Portugaliae Electrochimica Acta"
DOI: 10.4152/pea.201903147
Abstract: The present study aimed to evaluate the inhibition effect of an organic compound, namely, (E -N'-(2-hydroxybenzylidene) isonicotinohydrazide (BIH), for carbon steel corrosion in a 1.0 M HCl solution, by using weight loss (WL), potentiodynamic polarization… read more here.
Keywords: monte carlo; hcl solution; dft monte; carbon steel ... See more keywords