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dc.contributor.author
Gil Rebaza, Arles Víctor  
dc.contributor.author
Deluque Toro, Crispulo Enrique  
dc.contributor.author
Téllez Landínez, D. A  
dc.contributor.author
Roa Rojas, J.  
dc.date.available
2020-03-19T15:16:45Z  
dc.date.issued
2014-04  
dc.identifier.citation
Gil Rebaza, Arles Víctor; Deluque Toro, Crispulo Enrique; Téllez Landínez, D. A; Roa Rojas, J.; Electronic structure of the double perovskite Ba2Er(Nb,Sb)O 6; IOP Publishing; Journal of Physics: Conference Series; 480; 1; 4-2014; 1-5  
dc.identifier.issn
1742-6588  
dc.identifier.uri
http://hdl.handle.net/11336/100204  
dc.description.abstract
In this work, we present a detailed study of the structural and the electronic structure of the double perovskite Ba2Er(Nb,Sb)O 6. All calculations were performed with the Full-Potential Linear Augmented Plane Wave method (FP-LAPW) based on the Density Functional Theory (DFT). From the minimization of energy as a function of volume using the Murnaghan's state equation has been obtained the equilibrium lattice parameter and the bulk modulus of these compounds. The study of the electronic structure was based in the analysis of the electronic density of states (DOS), and the density of charge, showing that these compounds have a total magnetic moment of 3.0 μB per formula unit due to Er atoms.  
dc.format
application/pdf  
dc.language.iso
eng  
dc.publisher
IOP Publishing  
dc.rights
info:eu-repo/semantics/openAccess  
dc.rights.uri
https://creativecommons.org/licenses/by/2.5/ar/  
dc.subject
AB INITIO CALCULATIONS  
dc.subject
DOUBLE PEROVSKITE  
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MAGNETIC PROPERTIES  
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DENSITY OF STATES  
dc.subject.classification
Física de los Materiales Condensados  
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Ciencias Físicas  
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CIENCIAS NATURALES Y EXACTAS  
dc.title
Electronic structure of the double perovskite Ba2Er(Nb,Sb)O 6  
dc.type
info:eu-repo/semantics/article  
dc.type
info:ar-repo/semantics/artículo  
dc.type
info:eu-repo/semantics/publishedVersion  
dc.date.updated
2020-03-18T20:37:09Z  
dc.identifier.eissn
1742-6596  
dc.journal.volume
480  
dc.journal.number
1  
dc.journal.pagination
1-5  
dc.journal.pais
Estados Unidos  
dc.description.fil
Fil: Gil Rebaza, Arles Víctor. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto de Física La Plata. Universidad Nacional de La Plata. Facultad de Ciencias Exactas. Instituto de Física La Plata; Argentina  
dc.description.fil
Fil: Deluque Toro, Crispulo Enrique. Universidad Popular del Cesar; Colombia  
dc.description.fil
Fil: Téllez Landínez, D. A. Universidad Nacional de Colombia; Colombia  
dc.description.fil
Fil: Roa Rojas, J.. Universidad Nacional de Colombia; Colombia  
dc.journal.title
Journal of Physics: Conference Series  
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/url/http://iopscience.iop.org/1742-6596/480/1/012041  
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/doi/http://dx.doi.org/10.1088/1742-6596/480/1/012041  

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