Please use this identifier to cite or link to this item: http://hdl.handle.net/10995/102404
Title: Ruthenium-europium configuration in the Eu2Ru2O7 pyrochlore
Authors: Muñoz, Pérez, S.
Cobas, R.
Cadogan, J. M.
Albino, Aguiar, J.
Streltsov, S. V.
Obradors, X.
Issue Date: 2015
Publisher: American Institute of Physics Inc.
Citation: Ruthenium-europium configuration in the Eu2Ru2O7 pyrochlore / S. Muñoz Pérez, R. Cobas, J. M. Cadogan, et al. — DOI 10.1063/1.4906528 // Journal of Applied Physics. — 2015. — Vol. 117. — Iss. 17. — 17C702.
Abstract: The magnetic and electronic properties of Eu2Ru2O7 are discussed in terms of the local ruthenium and europium coordination, electronic band structure calculations, and molecular orbital energy levels. A preliminary electronic structure was calculated within the local density approximation (LDA) and local spin density approximation taking in to account on-site Hubbard U (LSDA + U). The molecular orbital energy level diagrams have been used to interpret the Eu-Ru ligand spectrum and the ensuing magnetic properties. The orbital hybridizations and bonds are discussed. © 2015 AIP Publishing LLC.
Keywords: ELECTRONIC PROPERTIES
ELECTRONIC STRUCTURE
MOLECULAR ORBITALS
RUTHENIUM
ELECTRONIC BAND STRUCTURE CALCULATION
HUBBARD
LOCAL SPIN DENSITY APPROXIMATION
LSDA + U
MAGNETIC AND ELECTRONIC PROPERTIES
MOLECULAR ORBITAL ENERGY
ORBITAL HYBRIDIZATION
PYROCHLORES
EUROPIUM
URI: http://hdl.handle.net/10995/102404
Access: info:eu-repo/semantics/openAccess
SCOPUS ID: 84923658978
PURE ID: 366456
61851420-28a8-4eca-8025-bc931cfd3d5a
ISSN: 218979
DOI: 10.1063/1.4906528
Appears in Collections:Научные публикации, проиндексированные в SCOPUS и WoS CC

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