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Theoretical study of the closed-shell d10-d10 Au(I)-Cu(I) attraction in complexes in extended unsupported chains
| Autor | dc.contributor.author | Rodríguez Castillo, María | |
| Autor | dc.contributor.author | Monge, Miguel | |
| Autor | dc.contributor.author | López de Luzuriaga, José M. | |
| Autor | dc.contributor.author | Olmos, M. Elena | |
| Autor | dc.contributor.author | Laguna, Antonio | |
| Autor | dc.contributor.author | Mendizábal Emaldía, Fernando | |
| Fecha ingreso | dc.date.accessioned | 2018-12-20T14:13:14Z | |
| Fecha disponible | dc.date.available | 2018-12-20T14:13:14Z | |
| Fecha de publicación | dc.date.issued | 2011 | |
| Cita de ítem | dc.identifier.citation | Computational and Theoretical Chemistry, Volumen 965, Issue 1, 2018, Pages 163-167 | |
| Identificador | dc.identifier.issn | 2210271X | |
| Identificador | dc.identifier.other | 10.1016/j.comptc.2011.01.040 | |
| Identificador | dc.identifier.uri | https://repositorio.uchile.cl/handle/2250/154923 | |
| Resumen | dc.description.abstract | Model compounds are used to study the metallophilic attraction between gold and copper atoms. Ab initio calculations on dimers and tetramers in different distributions of the simplified units are analyzed. An attraction is found for all models and there is a reasonable agreement between the experimental and theoretical geometries. © 2011 Elsevier B.V. | |
| Idioma | dc.language.iso | en | |
| Publicador | dc.publisher | Elsevier B.V. | |
| Tipo de licencia | dc.rights | Attribution-NonCommercial-NoDerivs 3.0 Chile | |
| Link a Licencia | dc.rights.uri | http://creativecommons.org/licenses/by-nc-nd/3.0/cl/ | |
| Fuente | dc.source | Computational and Theoretical Chemistry | |
| Palabras claves | dc.subject | Gold(I) Copper(I) | |
| Palabras claves | dc.subject | Metallophilic interaction | |
| Título | dc.title | Theoretical study of the closed-shell d10-d10 Au(I)-Cu(I) attraction in complexes in extended unsupported chains | |
| Tipo de documento | dc.type | Artículo de revista | |
| Catalogador | uchile.catalogador | SCOPUS | |
| Indización | uchile.index | Artículo de publicación SCOPUS | |
| uchile.cosecha | uchile.cosecha | SI |
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