Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain

[EN] A Corrigendum on The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain by Han, Z.-K., Zhang, L., Liu, M., Ganduglia-Pirovano, M. V., and Gao, Y. (2019). Front. Chem. 7:436. doi: 10.3389/fchem.2019.00436 In the original article, there was a mistake in Figure 8...

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Detalles Bibliográficos
Autores: Han, Zhong-Kang, Zhang, Lei, Liu, Meilin, Ganduglia-Pirovano, M. V., Gao, Yi
Tipo de recurso: artículo
Estado:Versión publicada
Fecha de publicación:2019
País:España
Institución:Consejo Superior de Investigaciones Científicas (CSIC)
Repositorio:DIGITAL.CSIC. Repositorio Institucional del CSIC
OAI Identifier:oai:digital.csic.es:10261/206704
Acceso en línea:http://hdl.handle.net/10261/206704
Access Level:acceso abierto
Palabra clave:Corrigenda
CeO2
Density functional theory
Oxygen vacancy
Strain
Surface structures
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spelling Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under StrainHan, Zhong-KangZhang, LeiLiu, MeilinGanduglia-Pirovano, M. V.Gao, YiCorrigendaCeO2Density functional theoryOxygen vacancyStrainSurface structures[EN] A Corrigendum on The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain by Han, Z.-K., Zhang, L., Liu, M., Ganduglia-Pirovano, M. V., and Gao, Y. (2019). Front. Chem. 7:436. doi: 10.3389/fchem.2019.00436 In the original article, there was a mistake in Figure 8 as published. The SSV and SSSV labeling in the top-right and bottom-left panels were interchanged. Moreover, in the bottom-right panel, the Densities of states (DOS) summed over spin projections and all atoms for a SSSV shown, did not correspond to those of the structure under the +4% strain with AB and 12 Ce3+ configurations and 5 × 5 periodicity, as indicated in the caption. The corrected Figure 8 appears below. The authors apologize for this error and state that this does not change the scientific conclusions of the article in any way. The original article has been updated.This work has been funded by the National Natural Science Foundation of China (11574340, 21773287) as well as by the US Department of Energy SECA Core Technology Program (DE-NT0006557) and DOE ARPA-E REBELS Program (DE-AR0000502). MVG-P acknowledges support by the MINECO- and MICINN-Spain (CTQ2015-71823-R and RTI2018-101604-B-I00, respectively). The computational resources utilized in this research have been provided by the National Supercomputing Center in Tianjin, the Shanghai Supercomputer Center and the Guangzhou Supercomputer Center, as well as by the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. This work used the Extreme Science and Engineering Discovery Environment (XSEDE), which is supported by National Science Foundation grant number TG-DMR170045. We thank Gustavo E. Murgida from the CAC-CNEA and CONICET-Argentina for fruitful discussions.Peer reviewedFrontiers MediaMinisterio de Economía y Competitividad (España)Ministerio de Ciencia, Innovación y Universidades (España)Consejo Superior de Investigaciones Científicas [https://ror.org/02gfc7t72]202020202019info:eu-repo/semantics/articlehttp://purl.org/coar/resource_type/c_7acdPublisher's versioninfo:eu-repo/semantics/publishedVersionhttp://hdl.handle.net/10261/206704reponame:DIGITAL.CSIC. Repositorio Institucional del CSICinstname:Consejo Superior de Investigaciones Científicas (CSIC)Inglés#PLACEHOLDER_PARENT_METADATA_VALUE##PLACEHOLDER_PARENT_METADATA_VALUE#info:eu-repo/grantAgreement/MINECO/Plan Estatal de Investigación Científica y Técnica y de Innovación 2013-2016/CTQ2015-71823-Rinfo:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/RTI2018-101604-B-I00Han Z-K, Zhang L, Liu M, Ganduglia-Pirovano MV and Gao Y (2019) Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain. Front. Chem. 7:795. doi: 10.3389/fchem.2019.00795 http://hdl.handle.net/10261/206052https://doi.org/10.3389/fchem.2019.00795Síinfo:eu-repo/semantics/openAccessoai:digital.csic.es:10261/2067042026-05-22T06:33:51Z
dc.title.none.fl_str_mv Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain
title Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain
spellingShingle Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain
Han, Zhong-Kang
Corrigenda
CeO2
Density functional theory
Oxygen vacancy
Strain
Surface structures
title_short Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain
title_full Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain
title_fullStr Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain
title_full_unstemmed Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain
title_sort Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain
dc.creator.none.fl_str_mv Han, Zhong-Kang
Zhang, Lei
Liu, Meilin
Ganduglia-Pirovano, M. V.
Gao, Yi
author Han, Zhong-Kang
author_facet Han, Zhong-Kang
Zhang, Lei
Liu, Meilin
Ganduglia-Pirovano, M. V.
Gao, Yi
author_role author
author2 Zhang, Lei
Liu, Meilin
Ganduglia-Pirovano, M. V.
Gao, Yi
author2_role author
author
author
author
dc.contributor.none.fl_str_mv Ministerio de Economía y Competitividad (España)
Ministerio de Ciencia, Innovación y Universidades (España)
Consejo Superior de Investigaciones Científicas [https://ror.org/02gfc7t72]
dc.subject.none.fl_str_mv Corrigenda
CeO2
Density functional theory
Oxygen vacancy
Strain
Surface structures
topic Corrigenda
CeO2
Density functional theory
Oxygen vacancy
Strain
Surface structures
description [EN] A Corrigendum on The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain by Han, Z.-K., Zhang, L., Liu, M., Ganduglia-Pirovano, M. V., and Gao, Y. (2019). Front. Chem. 7:436. doi: 10.3389/fchem.2019.00436 In the original article, there was a mistake in Figure 8 as published. The SSV and SSSV labeling in the top-right and bottom-left panels were interchanged. Moreover, in the bottom-right panel, the Densities of states (DOS) summed over spin projections and all atoms for a SSSV shown, did not correspond to those of the structure under the +4% strain with AB and 12 Ce3+ configurations and 5 × 5 periodicity, as indicated in the caption. The corrected Figure 8 appears below. The authors apologize for this error and state that this does not change the scientific conclusions of the article in any way. The original article has been updated.
publishDate 2019
dc.date.none.fl_str_mv 2019
2020
2020
dc.type.none.fl_str_mv info:eu-repo/semantics/article
http://purl.org/coar/resource_type/c_7acd
Publisher's version
info:eu-repo/semantics/publishedVersion
format article
status_str publishedVersion
dc.identifier.none.fl_str_mv http://hdl.handle.net/10261/206704
url http://hdl.handle.net/10261/206704
dc.language.none.fl_str_mv Inglés
language_invalid_str_mv Inglés
dc.relation.none.fl_str_mv #PLACEHOLDER_PARENT_METADATA_VALUE#
#PLACEHOLDER_PARENT_METADATA_VALUE#
info:eu-repo/grantAgreement/MINECO/Plan Estatal de Investigación Científica y Técnica y de Innovación 2013-2016/CTQ2015-71823-R
info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/RTI2018-101604-B-I00
Han Z-K, Zhang L, Liu M, Ganduglia-Pirovano MV and Gao Y (2019) Corrigendum: The Structure of Oxygen Vacancies in the Near-Surface of Reduced CeO2 (111) Under Strain. Front. Chem. 7:795. doi: 10.3389/fchem.2019.00795 http://hdl.handle.net/10261/206052
https://doi.org/10.3389/fchem.2019.00795
Sí
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.publisher.none.fl_str_mv Frontiers Media
publisher.none.fl_str_mv Frontiers Media
dc.source.none.fl_str_mv reponame:DIGITAL.CSIC. Repositorio Institucional del CSIC
instname:Consejo Superior de Investigaciones Científicas (CSIC)
instname_str Consejo Superior de Investigaciones Científicas (CSIC)
reponame_str DIGITAL.CSIC. Repositorio Institucional del CSIC
collection DIGITAL.CSIC. Repositorio Institucional del CSIC
repository.name.fl_str_mv
repository.mail.fl_str_mv
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