Výsledky vyhledávání - "Juliana O. Mendes"

On the nature of inhibition performance of imidazole on iron surface

Autor: Alexandre B. Rocha, Juliana O. Mendes, Edilson C. da Silva

Publikováno v: Corrosion Science. 57:254-259

Quantum mechanical calculations based on the Density Functional Theory under periodic boundary conditions were used to construct a model for the inhibition performance of imidazole on iron surface. It is shown that, at high coverage, imidazole molecu

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::1f6e0a8ec2f66d7100b3b5f55f38ad9c
https://doi.org/10.1016/j.corsci.2011.12.011

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Reply to comments on the paper 'On the nature of inhibition performance of imidazole on iron surface' by J.O. Mendes, E.C. da Silva, A.B. Rocha

Autor: Juliana O. Mendes, Alexandre B. Rocha

Publikováno v: Corrosion Science. 68:290-291

In, we present counter-arguments to the statements done on Kokalj’s comment to our previous paper. Particularly, we present the reasons why our results differ from his. The difference emerges on the treatment of magnetization. While Kokalj allows f

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::a9f5b0fe47f70147ec7df3f80f89edb0
https://doi.org/10.1016/j.corsci.2012.11.012

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