Ruthenium- europium configuration in the Eu2Ru2O7 pyrochlore

被引：5

作者：

Perez, S. Munoz ^{[1
]}

Cobas, R. ^{[1
]}

Cadogan, J. M. ^{[1
]}

Albino Aguiar, J. ^{[2
]}

Streltsov, S. V. ^{[3
,4
]}

Obradors, X. ^{[5
]}

机构：

[1] Univ New S Wales, Sch Phys Environm & Math Sci, Canberra, ACT 2610, Australia

[2] Univ Fed Pernambuco, Dept Fis, BR-50670901 Recife, PE, Brazil

[3] Russian Acad Sci, Inst Met Phys, Ekaterinburg 620219, Russia

[4] Ural Fed Univ, Dept Theoret Phys & Appl Math, Ekaterinburg 620002, Russia

[5] CSIC, Inst Ciencia Mat Barcelona, Bellaterra 08193, Spain

来源：

JOURNAL OF APPLIED PHYSICS | 2015年 / 117卷 / 17期

基金：

加拿大自然科学与工程研究理事会; 俄罗斯科学基金会;

关键词：

OPTICAL-TRANSITION INTENSITIES; RARE-EARTH IONS; R2RU2O7; R; SPIN; EU2TI2O7; LUMINESCENCE; ELEMENTS; SYSTEM; EU3+;

D O I：

10.1063/1.4906528

中图分类号：

O59 [应用物理学];

学科分类号：

摘要：

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. (C) 2015 AIP Publishing LLC.

引用

页数：4

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