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Gd-4f Exchange Splitting and Mo-4d Crystal-Field Redistribution in Gd/W Co-doped La2Mo2O9: A DFT+U Study
La2Mo2O9 (LAMOX) is a promising oxide-ion conductor for intermediate-temperature solid oxide fuel cells, but its practical application is limited by a first-order monoclinic-to-cubic (alpha to beta) phase transition. Here, we investigate the electronic structure of pristine La2Mo2O9 and the Gd/W co-
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