Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study

31

Detalhes bibliográficos
Autores: Chattaraj, PK, Gutierrez-Oliva, S, Jaque, P, Toro-Labbe, A
Formato: artículo
Estado:Versión publicada
Fecha de publicación:2003
País:Chile
Idioma:español
OAI Identifier:oai:repositorio.anid.cl:10533/174389
Acesso em linha:https://hdl.handle.net/10533/174389
Access Level:acceso abierto
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spelling Toro-Labbe, AJaque, PGutierrez-Oliva, SChattaraj, PK200310.1080/0026897032000112900https://hdl.handle.net/10533/174389http://purl.org/coar/access_right/c_abf2Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study28532841gbrLONDONChattaraj, PKGutierrez-Oliva, SJaque, PToro-Labbe, A2017-03-23T15:40:50Z2022-07-05T15:27:58Z2017-03-23T15:40:50Z2022-07-05T15:27:58Z200331FONDECYT18FONDECYT10110205341020534virtual::42967-1WOS:0001856865000030026-8976https://hdl.handle.net/10533/174389spaTAYLOR & FRANCIS LTD.instname: Conicytreponame: Repositorio Digital RI2.0instname: Conicytreponame: Repositorio Digital RI2.010.1080/0026897032000112900info:eu-repo/grantAgreement/Fondecyt/1020534info:eu-repo/semantics/dataset/hdl.handle.net/10533/93477https://doi.org/10.1080/0026897032000112900info:eu-repo/semantics/openAccessTowards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft studyMOLECULAR PHYSICSMOL PHYSArticuloinfo:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionArticulohttps://hdl.handle.net/10533/174389FONDECYThttp://purl.org/coar/resource_type/c_2df8fbb1787b2254-e838-49e1-a06f-ea14b9b8e17evirtual::42967-1787b2254-e838-49e1-a06f-ea14b9b8e17evirtual::42967-110533/174389oai:repositorio.anid.cl:10533/1743892023-07-24 17:18:14.297https://repositorio.anid.clRepositorio ANIDaletelier@anid.cl
dc.title.none.fl_str_mv Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study
dc.title.journal.none.fl_str_mv MOLECULAR PHYSICS
dc.title.journalabbreviation.none.fl_str_mv MOL PHYS
title Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study
spellingShingle Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study
Chattaraj, PK
title_short Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study
title_full Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study
title_fullStr Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study
title_full_unstemmed Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study
title_sort Towards understanding the molecular internal rotations and vibrations and chemical reactions through the profiles of reactivity and selectivity indices: an ab initio scf and dft study
dc.creator.none.fl_str_mv Chattaraj, PK
Gutierrez-Oliva, S
Jaque, P
Toro-Labbe, A
author Chattaraj, PK
author_facet Chattaraj, PK
Gutierrez-Oliva, S
Jaque, P
Toro-Labbe, A
author_role author
author2 Gutierrez-Oliva, S
Jaque, P
Toro-Labbe, A
author2_role author
author
author
description 31
publishDate 2003
dc.date.issued.none.fl_str_mv 2003
dc.date.accessioned.none.fl_str_mv 2017-03-23T15:40:50Z
2022-07-05T15:27:58Z
dc.date.available.none.fl_str_mv 2017-03-23T15:40:50Z
2022-07-05T15:27:58Z
dc.type.none.fl_str_mv Articulo
dc.type.driver.none.fl_str_mv info:eu-repo/semantics/article
dc.type.openaire.none.fl_str_mv info:eu-repo/semantics/publishedVersion
format article
status_str publishedVersion
dc.identifier.folio.none.fl_str_mv 1020534
1020534
dc.identifier.idwos.none.fl_str_mv WOS:000185686500003
dc.identifier.issn.none.fl_str_mv 0026-8976
dc.identifier.uri.none.fl_str_mv https://hdl.handle.net/10533/174389
identifier_str_mv 1020534
WOS:000185686500003
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language spa
dc.relation.none.fl_str_mv instname: Conicyt
reponame: Repositorio Digital RI2.0
instname: Conicyt
reponame: Repositorio Digital RI2.0
dc.relation.doi.none.fl_str_mv 10.1080/0026897032000112900
dc.relation.projectid.none.fl_str_mv info:eu-repo/grantAgreement/Fondecyt/1020534
dc.relation.set.none.fl_str_mv info:eu-repo/semantics/dataset/hdl.handle.net/10533/93477
dc.relation.uri.none.fl_str_mv https://doi.org/10.1080/0026897032000112900
dc.rights.driver.none.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.coverage.spatial.none.fl_str_mv LONDON
dc.publisher.none.fl_str_mv TAYLOR & FRANCIS LTD.
publisher.none.fl_str_mv TAYLOR & FRANCIS LTD.
repository.name.fl_str_mv Repositorio ANID
repository.mail.fl_str_mv aletelier@anid.cl
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score 15.81155

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