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Published in 2017 at "Physical Review B"
DOI: 10.1103/physrevb.95.045133
Abstract: We perform combined density functional and dynamical mean-field calculations to study the pyrochlore iridates Lu$_2$Ir$_2$O$_7$, Y$_2$Ir$_2$O$_7$ and Eu$_2$Ir$_2$O$_7$. Both single-site and cluster dynamical mean-field calculations are performed and spin-orbit coupling is included. Paramagnetic metallic phases,…
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Keywords:
pyrochlore iridates;
electron interactions;
dynamical mean;
mean field ... See more keywords
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Published in 2017 at "Physical review letters"
DOI: 10.1103/physrevlett.118.026404
Abstract: Combining density functional theory (DFT) and embedded dynamical mean-field theory (DMFT) methods, we study the metal-insulator transition in R_{2}Ir_{2}O_{7} (R=Y, Eu, Sm, Nd, Pr, and Bi) and the topological nature of the insulating compounds. Accurate…
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Keywords:
insulator transition;
transition topological;
metal insulator;
pyrochlore iridates ... See more keywords