Show simple item record

dc.contributor.authorGordillo, M.C. 
dc.contributor.authorMarti, J.
dc.date.accessioned2014-06-25T17:22:28Z
dc.date.available2014-06-25T17:22:28Z
dc.date.issued2011-07
dc.identifier.citationPhysical Review E - Statistical, Nonlinear, and Soft Matter Physics, 2011;84(1)
dc.identifier.issn1539-3755
dc.identifier.urihttp://hdl.handle.net/10433/980
dc.description.abstractWetting of a single hexagonal boron nitride sheet by liquid water has been investigated by molecular dynamics simulations within a temperature range between 278 and 373 K. The wetting temperature was found to be ~310 K, while the onset of prewetting happens around the much higher temperature of 354 K. The static (hydrogen-bond populations, density profiles, energy per molecule) and dynamic (diffusion coefficients) properties of water in the stable phases in this temperature range were also studied and compared to those of water on graphene. The results indicate that hydrophobicity of boron nitride is milder than that of graphene.
dc.description.sponsorshipUniversidad Pablo de Olavide. Departamento de Sistemas Físicos, Químicos y Naturales
dc.format.mimetypeapplication/pdf
dc.language.isoen
dc.publisherAmerican Physical Society
dc.relation.publisherversionDOI: http://dx.doi.org/10.1103/PhysRevE.84.011602
dc.rightsAmerican Physical Society
dc.subjectWetting
dc.subjectBoron nitride
dc.titleWetting and prewetting of water on top of a single sheet of hexagonal boron nitride
dc.typeinfo:eu-repo/semantics/article
dc.description.versionVersión del editor
dc.rights.accessRightsopenAccesses_ES


Files in this item

This item appears in the following Collection(s)

Show simple item record