Disclosing the behavior under hydrostatic pressure of rhombohedral MgIn2Se4 by means of first-principles calculations

Boukri, Khaled; Ouahrani, Tarik; Badawi, Michael; Demmouche, Kamel; Álvarez-Uría Franco, Ruth; Recio Muñiz, José Manuel

doi:10.1039/D0CP02842H

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Disclosing the behavior under hydrostatic pressure of rhombohedral MgIn2Se4 by means of first-principles calculations

dc.contributor.author	Boukri, Khaled
dc.contributor.author	Ouahrani, Tarik
dc.contributor.author	Badawi, Michael
dc.contributor.author	Demmouche, Kamel
dc.contributor.author	Álvarez-Uría Franco, Ruth
dc.contributor.author	Recio Muñiz, José Manuel
dc.date.accessioned	2021-02-10T07:35:36Z
dc.date.available	2021-02-10T07:35:36Z
dc.date.issued	2020
dc.identifier.citation	Physical Chemistry Chemical Physics, 22(38), p. 21909-21918 (2020); doi:10.1039/D0CP02842H
dc.identifier.issn	1463-9076
dc.identifier.uri	http://hdl.handle.net/10651/57842
dc.description.sponsorship	Financial support is from MCIU, Principado de Asturias-FICYT, and FEDER (projects PGC2018-094814-B-C22, FC-GRUPIN-IDI/2018/000177, RED2018-102612-T) and GENCI-CCRT (Grants No. A0080910433). We would like to thank the PMMS (Pole Messin de Mode ' lisation et de Simulation) and the MALTAConsolider computational facilities for providing us with the computational resources.	spa
dc.format.extent	p. 21909-21918	spa
dc.language.iso	eng	spa
dc.relation.ispartof	Physical Chemistry Chemical Physics, 22(38)	spa
dc.rights	© 2020 ROYAL SOCIETY OF CHEMISTRY
dc.rights	CC Reconocimiento - No Comercial - Sin Obra Derivada 4.0 Internacional
dc.rights.uri	http://creativecommons.org/licenses/by-nc-nd/4.0/
dc.title	Disclosing the behavior under hydrostatic pressure of rhombohedral MgIn2Se4 by means of first-principles calculations	spa
dc.type	journal article	spa
dc.identifier.doi	10.1039/D0CP02842H
dc.relation.projectID	MCIU/PGC2018-094814-B-C22	spa
dc.relation.projectID	FC-GRUPIN-IDI/2018/000177	spa
dc.relation.projectID	RED2018-102612-T	spa
dc.relation.publisherversion	https://doi.org/10.1039/D0CP02842H	spa
dc.rights.accessRights	open access
dc.type.hasVersion	AM

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