In pursuit of negative Fukui functions : examples where the highest occupied molecular orbital fails to dominate the chemical reactivity
dc.contributor.author | Echegaray Zipper, Eleonora Ana Luisa | |
dc.contributor.author | Cárdenas, C. | |
dc.contributor.author | Rabi, S. | |
dc.contributor.author | Lee, S. | |
dc.contributor.author | Zadeh, F. | |
dc.contributor.author | Toro Labbé, Alejandro | |
dc.contributor.author | Anderson, J. | |
dc.contributor.author | Ayers, P. | |
dc.contributor.author | Rabi, N. | |
dc.date.accessioned | 2021-01-14T19:10:55Z | |
dc.date.available | 2021-01-14T19:10:55Z | |
dc.date.issued | 2013 | |
dc.format.extent | 5 páginas | |
dc.fuente.origen | Converis | |
dc.identifier.doi | 10.1007/s00894-012-1637-3 | |
dc.identifier.issn | 1610-2940 | |
dc.identifier.uri | https://doi.org/10.1007/s00894-012-1637-3 | |
dc.identifier.uri | https://repositorio.uc.cl/handle/11534/50247 | |
dc.issue.numero | No. 7 | |
dc.language.iso | en | |
dc.nota.acceso | Contenido parcial | |
dc.pagina.final | 2783 | |
dc.pagina.inicio | 2779 | |
dc.revista | Journal of Molecular Modeling | es_ES |
dc.rights | acceso restringido | |
dc.subject.ddc | 510 | |
dc.subject.dewey | Matemática física y química | es_ES |
dc.subject.other | Orbitales moleculares | es_ES |
dc.subject.other | Estructura molecular | es_ES |
dc.subject.other | Electrones | es_ES |
dc.subject.other | Reactividad (química) | es_ES |
dc.title | In pursuit of negative Fukui functions : examples where the highest occupied molecular orbital fails to dominate the chemical reactivity | es_ES |
dc.type | artículo | |
dc.volumen | Vol. 19 | |
sipa.codpersvinculados | 99827 |
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