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Effects of van der Waals Interactions in the Adsorption of Isooctane and Ethanol on Fe(100) Surfaces

[Image: see text] van der Waals (vdW) forces play a fundamental role in the structure and behavior of diverse systems. Because of development of functionals that include nonlocal correlation, it is possible to study the effects of vdW interactions in systems of industrial and tribological interest....

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Detalles Bibliográficos
Autores principales: Bedolla, Pedro O., Feldbauer, Gregor, Wolloch, Michael, 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/PMC4126734/
https://www.ncbi.nlm.nih.gov/pubmed/25126156
http://dx.doi.org/10.1021/jp503829c