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• W1996810030 endingPage "14422" @default.
• W1996810030 startingPage "14414" @default.
• W1996810030 abstract "The linear-muffin-tin-orbital method is generalized to the case of relativistic and spin-polarized self-consistent band calculations. Our formalism is analogous to the standard orthogonal--linear-muffin-tin-orbital formalism, except that the potential functions and the potential parameters are now matrices. The method is used to perform density-functional calculations for fcc plutonium with different atomic volumes. The formation of spin and orbital magnetic moments, as well as the changes in the energy bands for volume changes corresponding to the ensuremath{alpha}-ensuremath{delta} transition, are investigated. The calculated magnetic moments agree quite well with the experimental ones." @default.
• W1996810030 created "2016-06-24" @default.
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• W1996810030 date "1991-06-15" @default.
• W1996810030 modified "2023-10-16" @default.
• W1996810030 title "Spin-polarized relativistic linear-muffin-tin-orbital method: Volume-dependent electronic structure and magnetic moment of plutonium" @default.
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• W1996810030 doi "https://doi.org/10.1103/physrevb.43.14414" @default.
• W1996810030 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/9997332" @default.
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