Experimental and theoretical determination of the low-loss electron energy loss spectroscopy of LiMn2O4

The dielectric properties of cubic spinel-type LiMn2O4, used as cathode material in lithium ion secondary batteries, are studied by analyzing the low-loss region of the electron energy loss spectroscopy (EELS) spectrum in a transmission electronmicroscope. A comparison of experimental EELS spectra a...

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Detalles Bibliográficos
Autores: FRANCISCO ESPINOSA MAGAÑA, LORENA ALVAREZ CONTRERAS, MARTHA TERESITA OCHOA LARA, ALFREDO AGUILAR ELGUEZABAL
Tipo de recurso: artículo
Estado:Versión enviada para evaluación y publicación
Fecha de publicación:2009
País:México
Institución:Centro de Investigación en Materiales Avanzados
Repositorio:Fuente de Objetos Científicos Open Access del CIMAV
Idioma:inglés
OAI Identifier:oai:cimav.repositorioinstitucional.mx:1004/1165
Acceso en línea:http://cimav.repositorioinstitucional.mx/jspui/handle/1004/1165
Access Level:acceso abierto
Palabra clave:info:eu-repo/classification/Ab initio/EELS
info:eu-repo/classification/Limn2O4/Electron structure
info:eu-repo/classification/cti/1
info:eu-repo/classification/cti/22
info:eu-repo/classification/cti/2299
info:eu-repo/classification/cti/229999
Descripción
Sumario:The dielectric properties of cubic spinel-type LiMn2O4, used as cathode material in lithium ion secondary batteries, are studied by analyzing the low-loss region of the electron energy loss spectroscopy (EELS) spectrum in a transmission electronmicroscope. A comparison of experimental EELS spectra and ab initio density-functional theory calculations (WIEN2k code) within the generalized gradient approximation (GGA) is presented. The origins of interband transitions are identified in the electronic band structure, by calculating the partial imaginary part of the dielectric function and the partial density of states of Li, Mn and O. Good agreement with experimental spectra is observed which allowed interpreting main features of the EELS spectrum.