High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa

The vibrational and structural behaviors of NiVO and CoVO orthovanadates have been studied up to around 20 GPa by means of X-ray diffraction, Raman spectra, and theoretical simulations. Both materials crystallize in an orthorhombic Kagomé staircase structure (space group: Cmca) at ambient conditions...

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Autores: Sánchez-Martín, J., Pellicer-Porres, Julio, Liang, A., Ibáñez Insa, Jordi, Oliva, Robert, Popescu, Catalina, He, Z., Rodríguez-Hernández, Plácida, Muñoz, Alfonso, Errandonea, Daniel
Formato: artículo
Estado:Versión publicada
Fecha de publicación:2023
País:España
Recursos:Consejo Superior de Investigaciones Científicas (CSIC)
Repositorio:DIGITAL.CSIC. Repositorio Institucional del CSIC
OAI Identifier:oai:digital.csic.es:10261/349634
Acesso em linha:http://hdl.handle.net/10261/349634
Access Level:acceso abierto
Palavra-chave:Cobalt compounds
Crystal symmetry
Equations of state
High pressure engineering
Nickel compounds
Single crystals
X ray diffraction
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spelling High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPaSánchez-Martín, J.Pellicer-Porres, JulioLiang, A.Ibáñez Insa, JordiOliva, RobertPopescu, CatalinaHe, Z.Rodríguez-Hernández, PlácidaMuñoz, AlfonsoErrandonea, DanielCobalt compoundsCrystal symmetryEquations of stateHigh pressure engineeringNickel compoundsSingle crystalsX ray diffractionThe vibrational and structural behaviors of NiVO and CoVO orthovanadates have been studied up to around 20 GPa by means of X-ray diffraction, Raman spectra, and theoretical simulations. Both materials crystallize in an orthorhombic Kagomé staircase structure (space group: Cmca) at ambient conditions, and no phase transition was found in the whole pressure range. In order to identify the symmetry of the detected Raman-active modes under high pressure, single crystal samples of those materials were used in a polarized Raman and infrared setup. Moreover, high-pressure powder X-ray diffraction measurements were performed for CoVO, and the results confirmed the structure stability also obtained by other diagnostic techniques. From this XRD analysis, the anisotropic compressibilities of all axes were calculated and the unit-cell volume vs pressure was fitted by a Birch-Murnaghan equation of state, obtaining a bulk modulus of 122 GPa.The authors gratefully acknowledge the financial support from the Spanish Research Agency (AEI) and Spanish Ministry of Science and Investigation (MCIN) under Projects PID2019-106383GB-41/43, PID2022-138076NB-C41/44 and RED2022-134388-T (DOI: 10.13039/501100011033 ). D.E. would also like to thank the financial support of Generalitat Valenciana under grants PROMETEO CIPROM/2021/075-GREENMAT and MFA/2022/007. This study forms part of the Advanced Materials program and is supported by MCIN with funding from European Union Next Generation EU (PRTR-C17.I1) and by the Generalitat Valenciana. J.S.-M. acknowledges the Spanish Ministry of Science, Innovation and Universities for the PRE2020-092198 fellowship. C.P. acknowledges Proyectos de Generación de Conocimiento PID2021-125927NB-C21. The authors thank ALBA synchrotron for providing beam time for the HP XRD experiments (Proposal 2021095390).Peer reviewedACS PublicationsMinisterio de Ciencia, Innovación y Universidades (España)Generalitat ValencianaMinisterio de Ciencia e Innovación (España)Consejo Superior de Investigaciones Científicas [https://ror.org/02gfc7t72]2024202420232024info:eu-repo/semantics/articlehttp://purl.org/coar/resource_type/c_6501Publisher's versioninfo:eu-repo/semantics/publishedVersionhttp://hdl.handle.net/10261/349634reponame:DIGITAL.CSIC. Repositorio Institucional del CSICinstname:Consejo Superior de Investigaciones Científicas (CSIC)Inglés#PLACEHOLDER_PARENT_METADATA_VALUE##PLACEHOLDER_PARENT_METADATA_VALUE##PLACEHOLDER_PARENT_METADATA_VALUE##PLACEHOLDER_PARENT_METADATA_VALUE##PLACEHOLDER_PARENT_METADATA_VALUE##PLACEHOLDER_PARENT_METADATA_VALUE#info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/PID2019-106383GB-C41info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2021-2023/PID2022-138076NB-C41info:eu-repo/grantAgreement/AEI//RED2022-134388-Tinfo:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/PID2019-106383GB-C43info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2021-2023/PID2022-138076NB-C44info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2021-2023/PID2021-125927NB-C21http://dx.doi.org/10.1021/acs.jpcc.3c04019Síinfo:eu-repo/semantics/openAccessoai:digital.csic.es:10261/3496342026-05-22T06:33:51Z
dc.title.none.fl_str_mv High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
title High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
spellingShingle High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
Sánchez-Martín, J.
Cobalt compounds
Crystal symmetry
Equations of state
High pressure engineering
Nickel compounds
Single crystals
X ray diffraction
title_short High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
title_full High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
title_fullStr High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
title_full_unstemmed High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
title_sort High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
dc.creator.none.fl_str_mv Sánchez-Martín, J.
Pellicer-Porres, Julio
Liang, A.
Ibáñez Insa, Jordi
Oliva, Robert
Popescu, Catalina
He, Z.
Rodríguez-Hernández, Plácida
Muñoz, Alfonso
Errandonea, Daniel
author Sánchez-Martín, J.
author_facet Sánchez-Martín, J.
Pellicer-Porres, Julio
Liang, A.
Ibáñez Insa, Jordi
Oliva, Robert
Popescu, Catalina
He, Z.
Rodríguez-Hernández, Plácida
Muñoz, Alfonso
Errandonea, Daniel
author_role author
author2 Pellicer-Porres, Julio
Liang, A.
Ibáñez Insa, Jordi
Oliva, Robert
Popescu, Catalina
He, Z.
Rodríguez-Hernández, Plácida
Muñoz, Alfonso
Errandonea, Daniel
author2_role author
author
author
author
author
author
author
author
author
dc.contributor.none.fl_str_mv Ministerio de Ciencia, Innovación y Universidades (España)
Generalitat Valenciana
Ministerio de Ciencia e Innovación (España)
Consejo Superior de Investigaciones Científicas [https://ror.org/02gfc7t72]
dc.subject.none.fl_str_mv Cobalt compounds
Crystal symmetry
Equations of state
High pressure engineering
Nickel compounds
Single crystals
X ray diffraction
topic Cobalt compounds
Crystal symmetry
Equations of state
High pressure engineering
Nickel compounds
Single crystals
X ray diffraction
description The vibrational and structural behaviors of NiVO and CoVO orthovanadates have been studied up to around 20 GPa by means of X-ray diffraction, Raman spectra, and theoretical simulations. Both materials crystallize in an orthorhombic Kagomé staircase structure (space group: Cmca) at ambient conditions, and no phase transition was found in the whole pressure range. In order to identify the symmetry of the detected Raman-active modes under high pressure, single crystal samples of those materials were used in a polarized Raman and infrared setup. Moreover, high-pressure powder X-ray diffraction measurements were performed for CoVO, and the results confirmed the structure stability also obtained by other diagnostic techniques. From this XRD analysis, the anisotropic compressibilities of all axes were calculated and the unit-cell volume vs pressure was fitted by a Birch-Murnaghan equation of state, obtaining a bulk modulus of 122 GPa.
publishDate 2023
dc.date.none.fl_str_mv 2023
2024
2024
2024
dc.type.none.fl_str_mv info:eu-repo/semantics/article
http://purl.org/coar/resource_type/c_6501
Publisher's version
info:eu-repo/semantics/publishedVersion
format article
status_str publishedVersion
dc.identifier.none.fl_str_mv http://hdl.handle.net/10261/349634
url http://hdl.handle.net/10261/349634
dc.language.none.fl_str_mv Inglés
language_invalid_str_mv Inglés
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#PLACEHOLDER_PARENT_METADATA_VALUE#
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info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/PID2019-106383GB-C41
info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2021-2023/PID2022-138076NB-C41
info:eu-repo/grantAgreement/AEI//RED2022-134388-T
info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/PID2019-106383GB-C43
info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2021-2023/PID2022-138076NB-C44
info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2021-2023/PID2021-125927NB-C21
http://dx.doi.org/10.1021/acs.jpcc.3c04019
Sí
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.publisher.none.fl_str_mv ACS Publications
publisher.none.fl_str_mv ACS Publications
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
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