Concepedia

Synthesis, characterization and corrosion inhibition studies of novel 8-hydroxyquinoline derivatives on the acidic corrosion of mild steel: Experimental and computational studies

Mohamed Rbaa, Hassane Lgaz, Y. El Kacimi, B. Lakhrissi, Fouad Bentiss, A. Zarrouk

Materials Discovery · 2018 · 67 citations · 61 references

DOI

Concepts

References

61

From molecules to solids with the DMol3 approach

B. Delley · The Journal of Chemical Physics · 2000 · 10.9K citations · Full text

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An all-electron numerical method for solving the local density functional for polyatomic molecules

B. Delley · The Journal of Chemical Physics · 1990 · 10.5K citations · Full text

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Ground states of molecules. 38. The MNDO method. Approximations and parameters

Michael J. S. Dewar, Walter Thiel · Journal of the American Chemical Society · 1977 · 5.1K citations

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Density functional approach to the frontier-electron theory of chemical reactivity

Robert G. Parr, Weitao Yang · Journal of the American Chemical Society · 1984 · 3.6K citations

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Absolute electronegativity and hardness: application to inorganic chemistry

Ralph G. Pearson · Inorganic Chemistry · 1988 · 3.4K citations

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