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Иш: Corrosion protection performance of eco-friendly inhibitor for zinc metal surface: Computational modeling

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
Chengteh Lee, Weitao Yang, Robert G. Parr
Мақола198884 иқтибос
ABI
General atomic and molecular electronic structure system
Michael W. Schmidt, Kim K. Baldridge, Jerry A. Boatz +10
Мақола199349 иқтибос
ABI
Density-functional exchange-energy approximation with correct asymptotic behavior
Axel D. Becke
Мақола198825 иқтибос
ABI
Recent developments in sustainable corrosion inhibitors: design, performance and industrial scale applications
Chandrabhan Verma, Eno E. Ebenso, M. A. Quraishi +1
Мақола202118 иқтибос
ABI
Papaya leaves extract as a novel eco-friendly corrosion inhibitor for Cu in H2SO4 medium
Bochuan Tan, Bin Xiang, Shengtao Zhang +4
Мақола202014 иқтибос
ABI
Über die Zuordnung von Wellenfunktionen und Eigenwerten zu den Einzelnen Elektronen Eines Atoms
Timo Koopmans
Мақола193412 иқтибос
ABI
Theoretical insight into an empirical rule about organic corrosion inhibitors containing nitrogen, oxygen, and sulfur atoms
Lei Guo, I.B. Obot, Xingwen Zheng +4
Мақола201711 иқтибос
ABI
Corrosion inhibitors: physisorbed or chemisorbed?
Anton Kokalj
Мақола20219 иқтибос
ABI
Electrophilicity Index
Robert G. Parr, László von Szentpály, Shubin Liu
Мақола19999 иқтибос
ABI
Molecular modelling of compounds used for corrosion inhibition studies: a review
Eno E. Ebenso, Chandrabhan Verma, Lukman O. Olasunkanmi +6
Шарҳ мақола20217 иқтибос
ABI
Natural population analysis
Alan E. Reed, Robert B. Weinstock, Frank Weinhold
Мақола19857 иқтибос
ABI
A Combined Experimental and Computational (DFT, RDF, MC and MD) Investigation of Epoxy Resin as a Potential Corrosion Inhibitor for Mild Steel in a 0.5 M H2SO4 Environment
Rachid Hsissou, Khadija Dahmani, Anouar El Magri +6
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ABI
Green synthesis, electrochemical, and DFT studies on the corrosion inhibition of steel by some novel triazole Schiff base derivatives in hydrochloric acid solution
Moataz M. Abdelsalam, Mahmoud A. Bedair, Mohd Ali Hassan +6
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ABI
On the HSAB based estimate of charge transfer between adsorbates and metal surfaces
Anton Kokalj
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Carissa macrocarpa extract (ECM) as a new efficient and ecologically friendly corrosion inhibitor for copper in nitric acid: Experimental and theoretical approach
Abdallah El-Asri, M. M. Rguiti, Aaziz Jmiai +4
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Gallium regulated MnO2 toward high performance Zn ion batteries
Lin Gao, Hao Hu, Chuankun Zhang +1
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Density Functional Theory (DFT) modeling and Monte Carlo simulation assessment of inhibition performance of some carbohydrazide Schiff bases for steel corrosion
I.B. Obot, Savaş Kaya, Cemal Kaya +1
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Theoretical study of benzimidazole and its derivatives and their potential activity as corrosion inhibitors
I.B. Obot, N.O. Obi-Egbedi
Мақола20093 иқтибос
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Innovating high-performance aqueous sodium-ion batteries with ice-resistant inorganic electrolytes for -40 °C applications
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Polarizable Continuum Model (PCM) Calculations of Solvent Effects on Optical Rotations of Chiral Molecules
Benedetta Mennucci, J. Tomasi, Roberto Cammi +5
Мақола20023 иқтибос
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An overview of computational and theoretical studies on analyzing adsorption performance of phytochemicals as metal corrosion inhibitors
Saddick Donkor, Zijian Song, Linhua Jiang +1
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Synthesis and localized inhibition behaviour of new triazine-methionine corrosion inhibitor in 1 M HCl for 2024-T3 aluminium alloy
Tianbao Zhang, Wenfeng Jiang, Hui‐Long Wang +1
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Quantum Chemical Study of the Inhibitive Properties of 2-Pyridyl-Azoles
Badhin Gómez, Natalya V. Likhanova, M.A. Domínguez-Aguilar +3
Мақола20062 иқтибос
ABI
Molecular Orbital Theoretical Studies of Some Organic Corrosion Inhibitors
V. S. Sastri, Jayarama R. Perumareddi
Мақола19972 иқтибос
ABI
Electrochemical and computational aspects of surface interaction and corrosion inhibition of mild steel in hydrochloric acid by Phyllanthus amarus leaf extract (PAE)
K.K. Anupama, K. Ramya, Abraham Joseph
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