Please use this identifier to cite or link to this item: http://hdl.handle.net/1942/29938
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dc.contributor.authorPROESMANS, Karel-
dc.contributor.authorFrenkel, Daan-
dc.date.accessioned2019-11-12T14:37:30Z-
dc.date.available2019-11-12T14:37:30Z-
dc.date.issued2019-
dc.identifier.citationJOURNAL OF CHEMICAL PHYSICS, 151(12) (Art N° 124109)-
dc.identifier.issn0021-9606-
dc.identifier.urihttp://hdl.handle.net/1942/29938-
dc.description.abstractWe report a numerical study of thermo-osmotic slip, i.e., the particle flux induced by a thermal gradient along a solid-fluid interface. To facilitate comparison with theory, we consider a model of an ideal but viscous gas. We compare three numerical routes to obtain the slip coefficient: (1) by using the Onsager reciprocity relations, (2) by using the appropriate Green-Kubo relation, and (3) via the excess enthalpy. The numerical results are found to be mutually consistent and to agree with the theoretical prediction based on the assumption that hydrodynamics and thermodynamics are locally valid.-
dc.description.sponsorshipK.P. is a postdoctoral fellow of the Research Foundation-Flanders (FWO). The computational resources and services used in this work were provided by the VSC (Flemish Supercomputer Center), funded by the Research Foundation - Flanders (FWO) and the Flemish Government department EWI-
dc.language.isoen-
dc.publisherAMER INST PHYSICS-
dc.rightsPublished under license by AIP Publishing-
dc.subject.otherChemistry, Physical; Physics, Atomic, Molecular & Chemical-
dc.titleComparing theory and simulation for thermo-osmosis-
dc.typeJournal Contribution-
dc.identifier.issue12-
dc.identifier.volume151-
local.format.pages6-
local.bibliographicCitation.jcatA1-
dc.description.notes[Proesmans, Karel] Hasselt Univ, B-3590 Diepenbeek, Belgium. [Frenkel, Daan] Univ Cambridge, Dept Chem, Lensfield Rd, Cambridge CB2 1EW, England.-
local.publisher.placeMELVILLE-
local.type.refereedRefereed-
local.type.specifiedArticle-
local.bibliographicCitation.artnr124109-
dc.identifier.doi10.1063/1.5123164-
dc.identifier.isi000488830300050-
item.fulltextWith Fulltext-
item.contributorPROESMANS, Karel-
item.contributorFrenkel, Daan-
item.fullcitationPROESMANS, Karel & Frenkel, Daan (2019) Comparing theory and simulation for thermo-osmosis. In: JOURNAL OF CHEMICAL PHYSICS, 151(12) (Art N° 124109).-
item.accessRightsOpen Access-
item.validationecoom 2020-
crisitem.journal.issn0021-9606-
crisitem.journal.eissn1089-7690-
Appears in Collections:Research publications
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