Modified radial LAPW basis functions and adjusted spin-orbit constants alter structural predictions for Ac, Th, ThO2 and UO2 and open a small gap at the Fermi level in UO2.
S¨ oderlind, Theory of the crystal structures of ceriu m and the light actinides, Advances in Physics 47, 959 (1998)
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Alternative treatment of relativistic effects in linear augmented plane wave (LAPW) method: application to Ac, Th, ThO2 and UO2
Modified radial LAPW basis functions and adjusted spin-orbit constants alter structural predictions for Ac, Th, ThO2 and UO2 and open a small gap at the Fermi level in UO2.