Charge ordering at the interface in (LaMnO)/(SrMnO) superlattices as the origin of their insulating state
arXiv:1402.3493 · doi:10.1063/1.4866271
Abstract
We have performed ab initio calculations within the LDA+U method in the multilayered system (LaMnO) / (SrMnO). Our results suggest a charge-ordered state that alternates Mn and Mn cations in a checkerboard in-plane pattern is developed at the interfacial layer, leading to a gap opening. Such an interfacial charge-ordered situation would be the energetically favored reconstruction between LaMnO and SrMnO. This helps understanding the insulating behavior observed experimentally in these multilayers at intermediate values of , whose origin is known to be due to some interfacial mechanism.
5 pages, 4 figures
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