Density Functional Investigation of the Adsorption of Isooctane, Ethanol, and Acetic Acid on a Water-Covered Fe(100) Surface

[Image: see text] The presence of water in biofuels poses the question of how it affects the frictional performance of additives in fuels containing organic substances. To investigate the effect of water on the adsorption of molecules present in fuel and its additives we simulated within the framewo...

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Detalles Bibliográficos
Autores principales: Bedolla, Pedro O., Feldbauer, Gregor, Wolloch, Michael, Gruber, Christoph, Eder, Stefan J., Dörr, Nicole, Mohn, Peter, Redinger, Josef, Vernes, András
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2014
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4166681/
https://www.ncbi.nlm.nih.gov/pubmed/25243045
http://dx.doi.org/10.1021/jp504695m

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4166681/
https://www.ncbi.nlm.nih.gov/pubmed/25243045
http://dx.doi.org/10.1021/jp504695m

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