http://www.cnr.it/ontology/cnr/individuo/prodotto/ID281989
Wettability of azobenzene self-assembled monolayers (Articolo in rivista)
- Type
- Label
- Wettability of azobenzene self-assembled monolayers (Articolo in rivista) (literal)
- Anno
- 2014-01-01T00:00:00+01:00 (literal)
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi
- 10.1021/la404922f (literal)
- Alternative label
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori
- Pipolo S.[ 1,2 ] ; Corni S. [ 3 ] (literal)
- Pagina inizio
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- http://www.scopus.com/inward/record.url?eid=2-s2.0-84899444046&partnerID=q2rCbXpz (literal)
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume
- Rivista
- Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroFascicolo
- Note
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- [ 1 ] Univ Modena & Reggio Emilia, CNR Inst Nanosci, Ctr S3, I-41125 Modena, Italy
[ 2 ] Univ Modena & Reggio Emilia, Dept Phys, I-41125 Modena, Italy
[ 3 ] Univ Modena & Reggio Emilia, CNR Inst Nanosci, Ctr S3, I-41121 Modena, Italy (literal)
- Titolo
- Wettability of azobenzene self-assembled monolayers (literal)
- Abstract
- The wettability properties of azobenzene self-assembled monolayers (SAMs), in the trans and cis forms, are investigated herein by classical Molecular Dynamics simulations of validated assembly structures described with a dedicated force field. The two different methodologies used for the calculation of the contact angle, one based on the Young's equation and the other on geometrical models, have provided a consistent description of the SAMs wettability in line with available experimental results. Furthermore, we provide an atomistic description of the first layers of water molecules at the solvent-SAM interface, which rationalizes the wettability difference between the cis- and trans-SAMs. © 2014 American Chemical Society. (literal)
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- Autore CNR
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