Interaction of silver with systems based on mordenites and mordenites combined with ionic liquids. An ONIOM-DFT study

Registro completo de metadados
MetadadosDescriçãoIdioma
Autor(es): dc.contributorZadorosny, Rafael-
Autor(es): dc.contributorUniversidade Estadual Paulista (UNESP), Department of Physics and Chemistry, Ilha Solteira Campus-
Autor(es): dc.creatorIzquierdo Soto, Rodolfo Enrique-
Data de aceite: dc.date.accessioned2025-08-21T19:14:32Z-
Data de disponibilização: dc.date.available2025-08-21T19:14:32Z-
Data de envio: dc.date.issued2024-08-07-
Data de envio: dc.date.issued2024-08-07-
Data de envio: dc.date.issued2024-07-25-
Fonte completa do material: dc.identifierhttps://hdl.handle.net/11449/256949-
Fonte completa do material: dc.identifierhttp://lattes.cnpq.br/5846151945852861-
Fonte completa do material: dc.identifierhttps://orcid.org/0000-0002-2978-8693-
Fonte: dc.identifier.urihttp://educapes.capes.gov.br/handle/11449/256949-
Descrição: dc.descriptionMaintaining the actual reduction in greenhouse gas emissions must not achieve the “1.5°C targets” of the Goals of UN to 2030 [1]. Tackling this issue requires the development of materials for the energy field at an unprecedented pace [2,3]. In particular, in 2022, we developed the UNESP 4432 project, which outlined the best experimental route for the synthesis of materials based on the combination of zeolites (e.g., mordenites: H-MOR, Na-MOR, etc.) with ionic liquids ([M]Cl], see Scheme 1), where [M]Cl were: chloride 1-(2-hydroxyethyl)-3-methyl-1H-imidazol-3-ium [2-HEMIm]Cl, chloride 1-(2-Amino-ethyl)-3-methyl-3H-imidazol-1-ium [2-AEMIm]Cl, chloride 1-(3-amino-propyl)-3-methyl-1H-imidazol-3-ium [3-APMIm]Cl, chloride R-1-(2-Amino-propyl)-3-methyl-3H-imidazol-1-ium [R-2-APMIm]Cl, and chloride S-1-(2-Amino-propyl)-3-methyl-3H-imidazol-1-ium [S-2-APMIm]Cl .Notwithstanding, Professor Zadorosny's group is concerned with improving YBCO-based superconducting ceramics. In this direction, incorporating silver in YBCO ceramics has attracted much interest recently. Therefore, in 2023 through the UNESP project # 5089 (CAPES # 88887.892023/2023-00) reported here, we explored some potential ways of incorporating silver in YBCO ceramic samples theoretically and experimentally. These strategies range from using [M]-MOR-type materials loaded with silver to strategies from Solution Blow Spinning (SBS).-
Descrição: dc.descriptionCoordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)-
Descrição: dc.descriptionCAPES: 88887.892023/2023-00-
Formato: dc.formatapplication/pdf-
Idioma: dc.languageen-
Publicador: dc.publisherUniversidade Estadual Paulista (UNESP)-
Direitos: dc.rightsinfo:eu-repo/semantics/restrictedAccess-
Palavras-chave: dc.subjectONIOM-
Palavras-chave: dc.subjectMordenite-
Palavras-chave: dc.subjectImidazolium-based ionic liquids-
Palavras-chave: dc.subjectSilver-
Título: dc.titleInteraction of silver with systems based on mordenites and mordenites combined with ionic liquids. An ONIOM-DFT study-
Título: dc.titleInteração da prata com sistemas à base de mordenitas e mordenitas combinadas com líquidos iônicos. Um estudo ONIOM-DFT-
Tipo de arquivo: dc.typeplanilha-
Aparece nas coleções:Repositório Institucional - Unesp

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