2001
DOI: 10.1103/physrevb.64.094434
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Relativistic corrections in magnetic systems

Abstract: We present a weak-relativistic limit comparison between the Kohn-Sham-Dirac equation and its approximate form containing the exchange coupling, which is used in almost all relativistic codes of density-functional theory. For these two descriptions, an exact expression of the Dirac Green's function in terms of the non-relativistic Green's function is first derived and then used to calculate the effective Hamiltonian, i.e., Pauli Hamiltonian, and effective velocity operator in the weak-relativistic limit. We poi… Show more

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Cited by 138 publications
(245 citation statements)
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“…Later on, Streda's separation of the offdiagonal conductivity in two parts has been rederived by using the Kubo formalism. 22 As we see from Eq. ͑20͒, the contribution yx …”
Section: Discussionsupporting
confidence: 58%
“…Later on, Streda's separation of the offdiagonal conductivity in two parts has been rederived by using the Kubo formalism. 22 As we see from Eq. ͑20͒, the contribution yx …”
Section: Discussionsupporting
confidence: 58%
“…There are, however, other contributions to the Hall effect that are ignored in such a theory including anomalous velocity 12,17,18,26,27 and the side-jump 6,[28][29][30][31][32][33] effects. The presence of these additional contributions is directly linked to induced nonzero interband elements of the density matrix, in other words, the interband coherence, as recognized since the work of Luttinger and Kohn.…”
Section: Introductionmentioning
confidence: 99%
“…However, it has not been used often in numerical calculations because of the complications of dealing with an integration in energy. Instead, it is possible to perform analytical integrations by parts [26] to obtain a more treatable expression for the static conductivity at zero temperature, which became known as the Kubo-Streda formula [27]. For the diagonal elements of the conductivity tensor (α = β), the integration leads to the Kubo-Greenwood formula [15].…”
mentioning
confidence: 99%
“…The expression above was first obtained by Bastin and collaborators in 1971 [1] and later generalized for any independent electron approximation [26]. However, it has not been used often in numerical calculations because of the complications of dealing with an integration in energy.…”
mentioning
confidence: 99%