Predictive Study of the Rare Earth Double Perovskite Oxide Ba2ErReO6 and the Influence of the Hubbard Parameter U on its Half-Metallicity
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DOI: 10.1007/s10948-021-06011-9
Abstract: In this paper, we have studied and carried out a theoretical calculation using the full-potential linearized augmented plane-wave method (FP-LAPW), based on density functional theory (DFT) and implemented in the wien2k program to investigate the… read more here.
Keywords: predictive study; ba2erreo6; double perovskite; hubbard parameter ... See more keywords