Magnetism and stability interplay : Correlations in simple BCC-based Fe intermetallic compounds

In this work, we present an ab initio study of a large set of simple, highly symmetrical ordered Fe-compounds (superlattices of the body-centered cubic structure, BCC), in order to analyze the role of the magnetism in the phase stability of these compounds. Our results, confirm that ferromagnetism a...

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Autores principales: Schön, Cláudio G., Gil Rebaza, Arles Víctor, Fernández Acevedo, Victoria, Eleno, Luiz T. F., Gonzales Ormeño, Pablo G., Errico, Leonardo Antonio, Petrilli, Helena M.
Formato: Articulo
Lenguaje:Inglés
Publicado: 2016
Materias:
Física
Ciencias Naturales
Ciencias Exactas
Body-centered cubic lattice
Enthalpy of formation
Ferromagnetism
First principles
Phase equilibria
Acceso en línea:http://sedici.unlp.edu.ar/handle/10915/95487
https://ri.conicet.gov.ar/11336/70417
Aporte de:
SEDICI (UNLP) de Universidad Nacional de La Plata
id I19-R120-10915-95487
record_format dspace
institution Universidad Nacional de La Plata
institution_str I-19
repository_str R-120
collection SEDICI (UNLP)
language Inglés
topic Física
Ciencias Naturales
Ciencias Exactas
Body-centered cubic lattice
Enthalpy of formation
Ferromagnetism
First principles
Phase equilibria
spellingShingle Física
Ciencias Naturales
Ciencias Exactas
Body-centered cubic lattice
Enthalpy of formation
Ferromagnetism
First principles
Phase equilibria
Schön, Cláudio G.
Gil Rebaza, Arles Víctor
Fernández Acevedo, Victoria
Eleno, Luiz T. F.
Gonzales Ormeño, Pablo G.
Errico, Leonardo Antonio
Petrilli, Helena M.
Magnetism and stability interplay : Correlations in simple BCC-based Fe intermetallic compounds
topic_facet Física
Ciencias Naturales
Ciencias Exactas
Body-centered cubic lattice
Enthalpy of formation
Ferromagnetism
First principles
Phase equilibria
description In this work, we present an ab initio study of a large set of simple, highly symmetrical ordered Fe-compounds (superlattices of the body-centered cubic structure, BCC), in order to analyze the role of the magnetism in the phase stability of these compounds. Our results, confirm that ferromagnetism and compound stability can be related. That is, the highest magnetic moments are observed for the least stable compounds. We also show that compounds have qualitatively different behavior as regards stability, according to whether their nature is ferromagnetic or non-magnetic.
format Articulo
Articulo
author Schön, Cláudio G.
Gil Rebaza, Arles Víctor
Fernández Acevedo, Victoria
Eleno, Luiz T. F.
Gonzales Ormeño, Pablo G.
Errico, Leonardo Antonio
Petrilli, Helena M.
author_facet Schön, Cláudio G.
Gil Rebaza, Arles Víctor
Fernández Acevedo, Victoria
Eleno, Luiz T. F.
Gonzales Ormeño, Pablo G.
Errico, Leonardo Antonio
Petrilli, Helena M.
author_sort Schön, Cláudio G.
title Magnetism and stability interplay : Correlations in simple BCC-based Fe intermetallic compounds
title_short Magnetism and stability interplay : Correlations in simple BCC-based Fe intermetallic compounds
title_full Magnetism and stability interplay : Correlations in simple BCC-based Fe intermetallic compounds
title_fullStr Magnetism and stability interplay : Correlations in simple BCC-based Fe intermetallic compounds
title_full_unstemmed Magnetism and stability interplay : Correlations in simple BCC-based Fe intermetallic compounds
title_sort magnetism and stability interplay : correlations in simple bcc-based fe intermetallic compounds
publishDate 2016
url http://sedici.unlp.edu.ar/handle/10915/95487
https://ri.conicet.gov.ar/11336/70417
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