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http://hdl.handle.net/1942/2869
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DC Field | Value | Language |
---|---|---|
dc.contributor.author | DELEUZE, Michael | - |
dc.contributor.author | Denis, JP | - |
dc.contributor.author | Delhalle, J | - |
dc.date.accessioned | 2007-11-20T10:30:06Z | - |
dc.date.available | 2007-11-20T10:30:06Z | - |
dc.date.issued | 2000 | - |
dc.identifier.citation | JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 501. p. 535-538 | - |
dc.identifier.issn | 0166-1280 | - |
dc.identifier.uri | http://hdl.handle.net/1942/2869 | - |
dc.description.abstract | The striking 10 degrees difference observed between contact angles of water for surfaces exposing methyl and methylene groups is investigated at the molecular level by comparing the relative binding energies (RHF/6-31G) of the H2O/nonane bimolecular complex for different docking directions. Of the attempts considered, it is found that the water molecule binds preferentially to methylene moieties, while the methyl group is the least favourable site. (C) 2000 Elsevier Science B.V. All rights reserved. | - |
dc.language.iso | en | - |
dc.publisher | ELSEVIER SCIENCE BV | - |
dc.subject.other | saturated hydrocarbons; supernatant water; molecular interactions; contact angles; wetting | - |
dc.title | On the wetting of saturated hydrocarbon surfaces. An exploratory molecular investigation | - |
dc.type | Journal Contribution | - |
dc.identifier.epage | 538 | - |
dc.identifier.spage | 535 | - |
dc.identifier.volume | 501 | - |
local.format.pages | 4 | - |
local.bibliographicCitation.jcat | A1 | - |
dc.description.notes | Limburgs Univ Ctr, Dept SBG, B-3590 Diepenbeek, Belgium. Fac Univ Notre Dame Paix, Lab Interdisciplinaire Spect Elect, B-5000 Namur, Belgium.Deleuze, M, Limburgs Univ Ctr, Dept SBG, Univ Campus, B-3590 Diepenbeek, Belgium. | - |
local.type.refereed | Refereed | - |
local.type.specified | Article | - |
dc.bibliographicCitation.oldjcat | A1 | - |
dc.identifier.isi | 000087541100059 | - |
item.fulltext | No Fulltext | - |
item.contributor | DELEUZE, Michael | - |
item.contributor | Denis, JP | - |
item.contributor | Delhalle, J | - |
item.validation | ecoom 2001 | - |
item.accessRights | Closed Access | - |
item.fullcitation | DELEUZE, Michael; Denis, JP & Delhalle, J (2000) On the wetting of saturated hydrocarbon surfaces. An exploratory molecular investigation. In: JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 501. p. 535-538. | - |
Appears in Collections: | Research publications |
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