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spelling 2024-05-16T13:46:59Z2024-05-16T13:46:59Z20222613061312https://doi.org/10.1021/jacsau.2c001512691-3704http://hdl.handle.net/1843/68398https://orcid.org/0000-0002-1819-0266https://orcid.org/0000-0001-9253-0401https://orcid.org/0000-0002-6662-660Xhttps://orcid.org/0000-0002-0024-1651https://orcid.org/0000-0003-0722-5352https://orcid.org/0000-0002-0838-7962CNPq - Conselho Nacional de Desenvolvimento Científico e TecnológicoFAPESP - Fundação de Amparo à Pesquisa do Estado de São PauloOutra AgênciaWe report improvement in the perovskite solar cell efficiency and stability after passivation with an organic molecule decorated with two anilinium cations. We compare this salt with its neutral analog and found that the change in the electron density distribution upon protonation and the presence of the halide anion are key to explaining the better passivation ability of the salt. In addition, we show that the counteranion has a significant impact on the performance of the device.engUniversidade Federal de Minas GeraisUFMGBrasilICX - DEPARTAMENTO DE QUÍMICAJACS AuCélulas solaresFuncionais de densidadeMoléculasSalDefect passivationStable perovskite solar cellsAggregation-induced luminogenDFT calculationRational synthesisImproving the stability and efficiency of perovskite solar cells by a bidentate anilinium saltinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articlehttps://pubs.acs.org/doi/10.1021/jacsau.2c00151Lucas ScalonRodrigo SzostakFrancineide Lopes de AraújoKarla Furtado AndrianiJulian Francisco Rama Vieira SilveiraWillian Xerxes Coelho OliveiraJuarez Lopes Ferreira da SilvaCaio Costa OliveiraAna Flávia Nogueiraapplication/pdfinfo:eu-repo/semantics/openAccessreponame:Repositório Institucional da UFMGinstname:Universidade Federal de Minas Gerais (UFMG)instacron:UFMGLICENSELicense.txtLicense.txttext/plain; charset=utf-82042https://repositorio.ufmg.br/bitstream/1843/68398/1/License.txtfa505098d172de0bc8864fc1287ffe22MD51ORIGINALImproving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt.pdfImproving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt.pdfapplication/pdf3322277https://repositorio.ufmg.br/bitstream/1843/68398/2/Improving%20the%20stability%20and%20efficiency%20of%20perovskite%20solar%20cells%20by%20a%20bidentate%20anilinium%20salt.pdfe74b2178ccbd9b3bfb768e9a97ac741cMD521843/683982024-05-16 10:46:59.846oai:repositorio.ufmg.br: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Repositório de PublicaçõesPUBhttps://repositorio.ufmg.br/oaiopendoar:2024-05-16T13:46:59Repositório Institucional da UFMG - Universidade Federal de Minas Gerais (UFMG)false
dc.title.pt_BR.fl_str_mv Improving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt
title Improving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt
spellingShingle Improving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt
Lucas Scalon
Defect passivation
Stable perovskite solar cells
Aggregation-induced luminogen
DFT calculation
Rational synthesis
Células solares
Funcionais de densidade
Moléculas
Sal
title_short Improving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt
title_full Improving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt
title_fullStr Improving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt
title_full_unstemmed Improving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt
title_sort Improving the stability and efficiency of perovskite solar cells by a bidentate anilinium salt
author Lucas Scalon
author_facet Lucas Scalon
Rodrigo Szostak
Francineide Lopes de Araújo
Karla Furtado Andriani
Julian Francisco Rama Vieira Silveira
Willian Xerxes Coelho Oliveira
Juarez Lopes Ferreira da Silva
Caio Costa Oliveira
Ana Flávia Nogueira
author_role author
author2 Rodrigo Szostak
Francineide Lopes de Araújo
Karla Furtado Andriani
Julian Francisco Rama Vieira Silveira
Willian Xerxes Coelho Oliveira
Juarez Lopes Ferreira da Silva
Caio Costa Oliveira
Ana Flávia Nogueira
author2_role author
author
author
author
author
author
author
author
dc.contributor.author.fl_str_mv Lucas Scalon
Rodrigo Szostak
Francineide Lopes de Araújo
Karla Furtado Andriani
Julian Francisco Rama Vieira Silveira
Willian Xerxes Coelho Oliveira
Juarez Lopes Ferreira da Silva
Caio Costa Oliveira
Ana Flávia Nogueira
dc.subject.por.fl_str_mv Defect passivation
Stable perovskite solar cells
Aggregation-induced luminogen
DFT calculation
Rational synthesis
topic Defect passivation
Stable perovskite solar cells
Aggregation-induced luminogen
DFT calculation
Rational synthesis
Células solares
Funcionais de densidade
Moléculas
Sal
dc.subject.other.pt_BR.fl_str_mv Células solares
Funcionais de densidade
Moléculas
Sal
description CNPq - Conselho Nacional de Desenvolvimento Científico e Tecnológico
publishDate 2022
dc.date.issued.fl_str_mv 2022
dc.date.accessioned.fl_str_mv 2024-05-16T13:46:59Z
dc.date.available.fl_str_mv 2024-05-16T13:46:59Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
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status_str publishedVersion
dc.identifier.uri.fl_str_mv http://hdl.handle.net/1843/68398
dc.identifier.doi.pt_BR.fl_str_mv https://doi.org/10.1021/jacsau.2c00151
dc.identifier.issn.pt_BR.fl_str_mv 2691-3704
dc.identifier.orcid.pt_BR.fl_str_mv https://orcid.org/0000-0002-1819-0266
https://orcid.org/0000-0001-9253-0401
https://orcid.org/0000-0002-6662-660X
https://orcid.org/0000-0002-0024-1651
https://orcid.org/0000-0003-0722-5352
https://orcid.org/0000-0002-0838-7962
url https://doi.org/10.1021/jacsau.2c00151
http://hdl.handle.net/1843/68398
https://orcid.org/0000-0002-1819-0266
https://orcid.org/0000-0001-9253-0401
https://orcid.org/0000-0002-6662-660X
https://orcid.org/0000-0002-0024-1651
https://orcid.org/0000-0003-0722-5352
https://orcid.org/0000-0002-0838-7962
identifier_str_mv 2691-3704
dc.language.iso.fl_str_mv eng
language eng
dc.relation.ispartof.pt_BR.fl_str_mv JACS Au
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv application/pdf
dc.publisher.none.fl_str_mv Universidade Federal de Minas Gerais
dc.publisher.initials.fl_str_mv UFMG
dc.publisher.country.fl_str_mv Brasil
dc.publisher.department.fl_str_mv ICX - DEPARTAMENTO DE QUÍMICA
publisher.none.fl_str_mv Universidade Federal de Minas Gerais
dc.source.none.fl_str_mv reponame:Repositório Institucional da UFMG
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