Concepedia

Synthesis and anticorrosive properties of epoxy polymer for CS in [1 M] HCl solution: Electrochemical, AFM, DFT and MD simulations

Rachid Hsissou, Said Abbout, Zaki Safi, F. Benhiba, Nuha Wazzan, Lei Guo, Khalid Nouneh, Samir Briche, H. Erramli, Mohammed Assouag,

Construction and Building Materials · 2020 · 136 citations · 65 references

DOI

Concepts

References

65

Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations

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Optimization by Simulated Annealing

Scott Kirkpatrick, C. D. Gelatt, M.P. Vecchi · Science · 1983 · 44.6K citations

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Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions

Aleksandr V. Marenich, Christopher J. Cramer, Donald G. Truhlar · The Journal of Physical Chemistry B · 2009 · 17.4K citations · Full text

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The use of global and local molecular parameters for the analysis of the gas-phase basicity of amines

Weitao Yang, Wilfried J. Mortier · Journal of the American Chemical Society · 1986 · 1.9K citations

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A computational study on corrosion inhibition performances of novel quinoline derivatives against the corrosion of iron

Şaban Erdoğan, Zaki Safi, Savaş Kaya et al. · Journal of Molecular Structure · 2017 · 334 citations

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