| Author | dc.contributor.author | Fernández, Eduardo J. | |
| Author | dc.contributor.author | Laguna, Antonio | es_CL |
| Author | dc.contributor.author | López de Luzuriaga, José M. | es_CL |
| Author | dc.contributor.author | Monge, Miguel | es_CL |
| Author | dc.contributor.author | Mendizábal Emaldía, Fernando | es_CL |
| Admission date | dc.date.accessioned | 2010-01-20T17:56:12Z | |
| Available date | dc.date.available | 2010-01-20T17:56:12Z | |
| Publication date | dc.date.issued | 2008 | |
| Cita de ítem | dc.identifier.citation | JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM Volume: 851 Issue: 1-3 Pages: 121-126 Published: FEB 28 2008 | en_US |
| Identifier | dc.identifier.issn | 0166-1280 | |
| Identifier | dc.identifier.other | 10.1016/j.theochem.2007.11.004 | |
| Identifier | dc.identifier.uri | https://repositorio.uchile.cl/handle/2250/118965 | |
| Abstract | dc.description.abstract | Model compounds are used to study the metallophilic attraction between gold and thallium atoms. Ab initio calculations on dimers and tetramers in different distributions of the minimal units are analyzed. An attraction is found for all models and there is a reasonable agreement between the experimental and theoretical geometries at the HF and MP2 levels. | en_US |
| Lenguage | dc.language.iso | en | en_US |
| Publisher | dc.publisher | ELSEVIER | en_US |
| Keywords | dc.subject | AB-INITIO | en_US |
| Título | dc.title | Theoretical study of the aggregation of d(10)-s(2) Au(I)-Tl(I) complexes in extended unsupported chains | en_US |
| Document type | dc.type | Artículo de revista | |
