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dc.contributor.author
Aguiar, Julio C.  
dc.contributor.author
Di Rocco, Hector Omar  
dc.contributor.author
Mitnik, Dario Marcelo  
dc.date.available
2016-08-10T22:11:23Z  
dc.date.issued
2013-07  
dc.identifier.citation
Aguiar, Julio C.; Di Rocco, Hector Omar; Mitnik, Dario Marcelo; Experimental Compton profiles of Be, Al and Ti and comparisons to generalized gradient approximation calculations; Elsevier; Journal of Physics and Chemistry of Solids; 74; 10; 7-2013; 1341-1348  
dc.identifier.issn
0022-3697  
dc.identifier.uri
http://hdl.handle.net/11336/7078  
dc.description.abstract
Experimental analysis of isotropic Compton profiles for beryllium, aluminum and titanium was performed to assess the radial core wavefunctions and pseudo-orbitals for valence electrons generated using a generalized gradient approximation based on norm-conserving pseudo-potential calculations. Compton profiles for the different core and valence electron shells are presented in tabulated electron momentum transfer values from q=0 to 9 a.u. Derivatives of the Compton profiles were also calculated to identify the Fermi momenta. Comparison of our results to previous experimental and theoretical calculations shows acceptable agreement in most cases. Our findings indicate that the Compton profiles for Be, Al and Ti are reasonably well described within the generalized gradient approximation.  
dc.format
application/pdf  
dc.language.iso
eng  
dc.publisher
Elsevier  
dc.rights
info:eu-repo/semantics/openAccess  
dc.rights.uri
https://creativecommons.org/licenses/by-nc-nd/2.5/ar/  
dc.subject
Compton  
dc.subject.classification
Física de los Materiales Condensados  
dc.subject.classification
Ciencias Físicas  
dc.subject.classification
CIENCIAS NATURALES Y EXACTAS  
dc.title
Experimental Compton profiles of Be, Al and Ti and comparisons to generalized gradient approximation calculations  
dc.type
info:eu-repo/semantics/article  
dc.type
info:ar-repo/semantics/artículo  
dc.type
info:eu-repo/semantics/publishedVersion  
dc.date.updated
2016-03-02T13:41:01Z  
dc.journal.volume
74  
dc.journal.number
10  
dc.journal.pagination
1341-1348  
dc.journal.pais
Países Bajos  
dc.journal.ciudad
Amsterdam  
dc.description.fil
Fil: Aguiar, Julio C.. Autoridad Regulatoria Nuclear; Argentina. Universidad Nacional del Centro de la Provincia de Buenos Aires. Facultad de Ciencias Exactas. Instituto de Fisica Arroyo Seco; Argentina  
dc.description.fil
Fil: Di Rocco, Hector Omar. Universidad Nacional del Centro de la Provincia de Buenos Aires. Facultad de Ciencias Exactas. Instituto de Fisica Arroyo Seco; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Tandil. Centro de Investigaciones en Física e Ingeniería del Centro de la Provincia de Buenos Aires; Argentina  
dc.description.fil
Fil: Mitnik, Dario Marcelo. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales. Instituto de Astronomía y Física del Espacio; Argentina  
dc.journal.title
Journal of Physics and Chemistry of Solids  
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/doi/10.1016/j.jpcs.2013.04.018  
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/doi/http://dx.doi.org/10.1016/j.jpcs.2013.04.018  
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/url/http://www.sciencedirect.com/science/article/pii/S0022369713001790