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dc.contributor.authorOrdóñez-Lasso, Andrés Felipe
dc.contributor.authorSanz Vicario, José Luis
dc.contributor.authorMartín García, Fernando 
dc.contributor.otherUAM. Departamento de Químicaes_ES
dc.date.accessioned2016-09-07T14:21:19Z
dc.date.available2016-09-07T14:21:19Z
dc.date.issued2015-09-07
dc.identifier.citationJournal of Physics: Conference Series 635.7 (2015): 072026en_US
dc.identifier.issn1742-6588 (Print)es_ES
dc.identifier.issn1742-6596 (Online)es_ES
dc.identifier.urihttp://hdl.handle.net/10486/672744
dc.description.abstractWe perform a systematic study on the behaviour of energy positions and autoionization widths of metastable resonance states in the Hydrogen molecule subject to screened Coulomb interactions among all particles using an ab initio Feshbach configuration interaction method. We only focus on the Q1 series of doubly excited states lying between the first H2 +(1sσg) and the second H2 +(2pσu) ionization thresholds, for several spectroscopic molecular symmetries 1,3Σg u, 1,3Πg, u and 1,3Δg, u. Special attention is given to the efficient and accurate method for the evaluation of screened Coulomb two-electron integrals in molecules when using configurations in terms of molecular orbitals described using a B-spline basisen_US
dc.format.extent1 pag.es_ES
dc.format.mimetypeapplication/pdfen
dc.language.isoengen
dc.publisherIOP Publishing Ltd.en_US
dc.relation.ispartofJournal of Physics: Conference Seriesen_US
dc.rights© Published under licence by IOP Publishing Ltd.en_US
dc.subject.otherMolecular orbitalsen_US
dc.subject.otherConfiguration interaction methoden_US
dc.subject.otherDoubly excited stateen_US
dc.subject.otherIonization thresholdsen_US
dc.titlePlasma screening effects in molecular hydrogen: modified energies and lifetimes of doubly excited statesen_US
dc.typearticleen
dc.subject.ecienciaQuímicaes_ES
dc.relation.publisherversionhttp://dx.doi.org/10.1088/1742-6596/635/7/072026es_ES
dc.identifier.doi10.1088/1742-6596/635/7/072026es_ES
dc.identifier.publicationfirstpage1es_ES
dc.identifier.publicationissue7es_ES
dc.identifier.publicationlastpage1es_ES
dc.identifier.publicationvolume635es_ES
dc.type.versioninfo:eu-repo/semantics/publishedVersionen
dc.rights.ccReconocimientoes_ES
dc.rights.accessRightsopenAccessen
dc.facultadUAMFacultad de Ciencias


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