Concepedia

Aminomethylpyridazine isomers as corrosion inhibitors for mild steel in 1 M HCl: Electrochemical, DFT and Monte Carlo simulation studies

Motsie E. Mashuga, Lukman O. Olasunkanmi, Hassane Lgaz, El‐Sayed M. Sherif, Eno E. Ebenso

Journal of Molecular Liquids · 2021 · 50 citations · 38 references

DOI

Concepts

References

38

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert G. Parr · Physical review. B, Condensed matter · 1988 · 100.1K citations

, , +17

Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules

R. Ditchfield, Warren J. Hehre, John A. Pople · The Journal of Chemical Physics · 1971 · 10.5K citations

, , +15

Absolute hardness: companion parameter to absolute electronegativity

Robert G. Parr, Ralph G. Pearson · Journal of the American Chemical Society · 1983 · 7.8K citations

, , +6

The COMPASS force field: parameterization and validation for phosphazenes

Huai Sun, Pengyu Ren, Joel Fried · Computational and Theoretical Polymer Science · 1998 · 1.5K citations

, , +7

Caffeic acid as a green corrosion inhibitor for mild steel

Fernando S. de Souza, Almir Spinelli · Corrosion Science · 2008 · 642 citations

, , +16