Understanding the shape effect on the structural, energetic, magnetic, and pressure properties of the 38 atom-Co-Fe-Pd nanoalloys using Gupta and DFT calculations

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dc.authoridTaran, Songul/0000-0001-8115-2169
dc.authoridArslan, Haydar/0000-0002-6624-9314
dc.authoridYILDIRIM, Huseyin/0000-0002-8554-3885
dc.contributor.authorYildirim, Huseyin
dc.contributor.authorTaran, Songul
dc.contributor.authorArslan, Haydar
dc.date.accessioned2024-09-29T16:03:02Z
dc.date.available2024-09-29T16:03:02Z
dc.date.issued2024
dc.departmentKarabük Üniversitesien_US
dc.description.abstractThe alloy of magnetic metals with noble metals plays a key role in showing the magnetism of 3d metals and the catalytic properties of noble metals. A growing body of evidence suggests that 38 atoms is one of the most critical sizes for Ih and TO motifs. This study analyses the roles played by the shape effect on the structures, energies, magnetism, and pressures of Co6FenPd32-n (n = 0-32) nanoalloys and provides evidence regarding this phenomenon. Therefore, this study should be of value to researchers wishing to conduct future experimental and theoretical studies on the catalytic, electronic, optical, and magnetic properties of nanoalloys.en_US
dc.identifier.doi10.1088/1402-4896/ad4ca3
dc.identifier.issn0031-8949
dc.identifier.issn1402-4896
dc.identifier.issue6en_US
dc.identifier.scopus2-s2.0-85194469197en_US
dc.identifier.scopusqualityQ2en_US
dc.identifier.urihttps://doi.org/10.1088/1402-4896/ad4ca3
dc.identifier.urihttps://hdl.handle.net/20.500.14619/5862
dc.identifier.volume99en_US
dc.identifier.wosWOS:001233338000001en_US
dc.identifier.wosqualityN/Aen_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.indekslendigikaynakScopusen_US
dc.language.isoenen_US
dc.publisherIop Publishing Ltden_US
dc.relation.ispartofPhysica Scriptaen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.subjectnanoalloysen_US
dc.subjectmagnetismen_US
dc.subjectatomic pressureen_US
dc.subjectoptimizationen_US
dc.subjectdensity functional theoryen_US
dc.titleUnderstanding the shape effect on the structural, energetic, magnetic, and pressure properties of the 38 atom-Co-Fe-Pd nanoalloys using Gupta and DFT calculationsen_US
dc.typeArticleen_US

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