Abstract:A many‐body calculation is implemented on a strongly correlated metal Ce3Pb by density functional theory plus dynamical mean‐field theory, including 4f−4f electron correlation, 4f‐conduction electron hybridization and relativistic effects. Calculation results suggest that j = 5/2 and j = 7/2 manifolds are in partially filled and empty states, respectively. Negligible contributions of 4 f°, 4f2, and 4f3 configurations give the occupation number of 4f electrons n4f about 1.0, indicating the high 4f localization … Show more
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