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An Ultrahigh CO2-Loaded Silicalite-1 Zeolite: Structural Stability and Physical Properties at High Pressures and Temperatures

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An Ultrahigh CO2-Loaded Silicalite-1 Zeolite: Structural Stability and Physical Properties at High Pressures and Temperatures

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dc.contributor.author Marqueno, Tomas es_ES
dc.contributor.author Santamaria-Perez, David es_ES
dc.contributor.author Ruiz-Fuertes, Javier es_ES
dc.contributor.author Chulia-Jordan, Raquel es_ES
dc.contributor.author Jorda Moret, Jose Luis es_ES
dc.contributor.author Rey Garcia, Fernando es_ES
dc.contributor.author McGuire, Chris es_ES
dc.contributor.author Kavner, Abby es_ES
dc.contributor.author MacLeod, Simon es_ES
dc.contributor.author Daisenberger, Dominik es_ES
dc.contributor.author Popescu, Catalin es_ES
dc.contributor.author Rodríguez-Hernández, Plácida es_ES
dc.contributor.author Munoz, Alfonso es_ES
dc.date.accessioned 2022-10-03T18:06:03Z
dc.date.available 2022-10-03T18:06:03Z
dc.date.issued 2018-06-04 es_ES
dc.identifier.issn 0020-1669 es_ES
dc.identifier.uri http://hdl.handle.net/10251/186863
dc.description.abstract [EN] We report the formation of an ultrahigh CO2-loaded pure-SiO2, silicalite-1 structure at high pressure (0.7 GPa) from the interaction of empty zeolite and fluid CO, medium. The CO2-filled structure was characterized in situ by means of synchrotron powder X-ray diffraction. Rietveld refinements and Fourier recycling allowed the location of 16 guest carbon dioxide molecules per unit cell within the straight and sinusoidal channels of the porous framework to be analyzed. The complete filling of pores by CO, molecules favors structural stability under compression, avoiding pressure-induced amorphization below 20 GPa, and significantly reduces the compressibility of the system compared to that of the parental empty one. The structure of CO2-loaded silicalite-1 was also monitored at high pressures and temperatures, and its thermal expansivity was estimated. es_ES
dc.description.sponsorship The authors thank the Spanish Ministerio de Economia y Competitividad (MINECO), the Spanish Research Agency (AEI), and the European Fund for Regional Development (FEDER) for their financial support (MAT2016-75586-C4-1-P, MAT2016-75586-C4-3-P, MAT2015-71842-P; Severo Ochoa SEV-2012-0267; and MAT2015-71070-REDC (MALTA Consolider)). D.S.-P. and J.R-F. acknowledge MINECO for a Ramon y Cajal (RyC-2014-15643) and a Juan de la Cierva (IJCI-2014-20513) contract, respectively. A.K. acknowledges the support of the University of Valencia through the Grant UV-INV-EPC17-548561. Portions of this work were performed at GeoSoilEnviroCARS (Sector 13), Advanced Photon Source (APS), and Argonne National Laboratory. GeoSoilEnviroCARS is supported by the National Science Foundation, Earth Sciences (EAR-1128799), and the Department of Energy, GeoSciences (DE-FG02-94ER14466). This research used resources from the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory (DE-AC02-06CH11357). Use of the COMPRES-GSECARS gas loading system was supported by COMPRES under NSF Cooperative Agreement EAR 11-57758. CO2 gas was also loaded at Diamond Light Source. The authors thank the synchrotron facility ALBA-CELLS for beamtime allocation at MSPD line. es_ES
dc.language Inglés es_ES
dc.publisher American Chemical Society es_ES
dc.relation.ispartof Inorganic Chemistry es_ES
dc.rights Reserva de todos los derechos es_ES
dc.title An Ultrahigh CO2-Loaded Silicalite-1 Zeolite: Structural Stability and Physical Properties at High Pressures and Temperatures es_ES
dc.type Artículo es_ES
dc.identifier.doi 10.1021/acs.inorgchem.8b00523 es_ES
dc.relation.projectID info:eu-repo/grantAgreement/MINECO//IJCI-2014-20513/ES/IJCI-2014-20513/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/UV//UV-INV-EPC17-548561/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/MINECO//MAT2015-71070-REDC/ES/MATERIA A ALTA PRESION. MALTA-CONSOLIDER TEAM/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/MINECO//MAT2016-75586-C4-1-P/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/MINECO//MAT2015-71842-P/ES/SINTESIS Y CARACTERIZACION AVANZADA DE NUEVOS MATERIALES ZEOLITICOS Y APLICACIONES EN ADSORCION, MEDIOAMBIENTE Y EN LA CONSERVACION DE ALIMENTOS/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/MINECO//MAT2016-75586-C4-3-P/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/MINECO//RYC-2014-15643/ES/RYC-2014-15643/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/MINISTERIO DE ECONOMIA Y COMPETITIVIDAD//SEV-2012-0267//Centros y Unidades de Excelencia Severo Ochoa/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/NSF//EAR 11-57758/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/NSF//EAR-1128799/ es_ES
dc.relation.projectID info:eu-repo/grantAgreement/DOE//DE-FG02-94ER14466/ es_ES
dc.rights.accessRights Abierto es_ES
dc.contributor.affiliation Universitat Politècnica de València. Instituto Universitario Mixto de Tecnología Química - Institut Universitari Mixt de Tecnologia Química es_ES
dc.description.bibliographicCitation Marqueno, T.; Santamaria-Perez, D.; Ruiz-Fuertes, J.; Chulia-Jordan, R.; Jorda Moret, JL.; Rey Garcia, F.; Mcguire, C.... (2018). An Ultrahigh CO2-Loaded Silicalite-1 Zeolite: Structural Stability and Physical Properties at High Pressures and Temperatures. Inorganic Chemistry. 57(11):6447-6455. https://doi.org/10.1021/acs.inorgchem.8b00523 es_ES
dc.description.accrualMethod S es_ES
dc.relation.publisherversion https://doi.org/10.1021/acs.inorgchem.8b00523 es_ES
dc.description.upvformatpinicio 6447 es_ES
dc.description.upvformatpfin 6455 es_ES
dc.type.version info:eu-repo/semantics/publishedVersion es_ES
dc.description.volume 57 es_ES
dc.description.issue 11 es_ES
dc.identifier.pmid 29737842 es_ES
dc.relation.pasarela S\384742 es_ES
dc.contributor.funder Universitat de València es_ES
dc.contributor.funder U.S. Department of Energy es_ES
dc.contributor.funder National Science Foundation, EEUU es_ES
dc.contributor.funder MINISTERIO DE ECONOMIA Y COMPETITIVIDAD es_ES
dc.contributor.funder Ministerio de Economía y Competitividad es_ES
dc.contributor.funder Ministerio de Economía y Competitividad y Fondo Europeo de Desarrollo Regional (FEDER) es_ES


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