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dc.contributor.authorSola Llano, Rebeca
dc.contributor.authorMartínez Martínez, Virginia ORCID
dc.contributor.authorFujita, Yasuhiko
dc.contributor.authorGómez Hortigüela, Luis
dc.contributor.authorAlfayate, Almudena
dc.contributor.authorUji-i, Hiroshi
dc.contributor.authorFron, Eduard
dc.contributor.authorPérez Pariente, Joaquín
dc.contributor.authorLópez Arbeloa, Iñigo
dc.date.accessioned2024-02-08T09:54:26Z
dc.date.available2024-02-08T09:54:26Z
dc.date.issued2016-09-15
dc.identifier.citationChemistry a European Journal 22(44) : 15700-15711 (2016)es_ES
dc.identifier.issn0947-6539
dc.identifier.issn1521-3765
dc.identifier.urihttp://hdl.handle.net/10810/65163
dc.description.abstractIn this work, hemicyanine dye LDS 722, is encapsulated into the 1-D elliptical nano-channels of MgAPO-11 aluminophosphate by crystallization inclusion method. The synthesis of the hybrid material has been optimized through a systematic variation of the crystallization conditions in order to obtain pure and large crystals (around 20 μm x 30 μm) suitable for optical applications. The tight fitting between the molecular size of the guest dye and the pore dimensions of the host has favored a rigid planar conformation of the dye, restricting its inherent flexibility, which is confirmed by molecular simulations. Consequently, the encapsulation of LDS 722 into MgAPO-11 has led to an astonishing enhancement of the fluorescence with respect to another analogous nanoporous aluminophosphate, MgAPO-5, with slightly larger cylindrical channels, and with respect to the dye in solution. Moreover, the perfect alignment of LDS 722 (dye with intrinsic nonlinear-optical properties) along the channels of MgAPO-11 has rendered attractive second-order non-linear properties such as second harmonic generation, proven through microscopy measurements in single crystals.es_ES
dc.description.sponsorshipThe authors thank the Spanish Ministry of Economy and Innovation MINECO (MAT 2014-51937-C3-3 and MAT2012- 31127) and Basque Government (IT339-10 and IT912-16) for funding this research. VMM and LGH acknowledge Ministerio de Economía y Competitividad MINECO for ‘Ramón y Cajal’ (RYC-2011-09505 and RYC-2012-11794, respectively) contracts and RSL acknowledges Universidad del País Vasco (UPV-EHU) for a predoctoral contract. Centro Técnico Informático-CSIC is acknowledged for running the calculations, and Accelrys for providing the computational software.es_ES
dc.language.isoenges_ES
dc.publisherWiley
dc.rightsinfo:eu-repo/semantics/openAccesses_ES
dc.subjectAEL structurees_ES
dc.subjectNLO dyees_ES
dc.subjectcrystallization inclusion methodes_ES
dc.subjectmolecular modelinges_ES
dc.subjectSHGes_ES
dc.titleFormation of a Nonlinear Optical Host–Guest Hybrid Material by Tight Confinement of LDS 722 into Aluminophosphate 1D Nanochannelses_ES
dc.typeinfo:eu-repo/semantics/articlees_ES
dc.relation.publisherversionhttps://chemistry-europe.onlinelibrary.wiley.com/doi/10.1002/chem.201601736
dc.identifier.doi10.1002/chem.201601736
dc.departamentoesQuímica físicaes_ES
dc.departamentoeuKimika fisikoaes_ES


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