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- W3100884464 endingPage "012055" @default.
- W3100884464 startingPage "012055" @default.
- W3100884464 abstract "While in strongly correlated materials one often focuses on local electronic correlations, the influence of non-local exchange and correlation effects beyond band-theory can be pertinent in systems with more extended orbitals. Thus in many compounds an adequate theoretical description requires the joint treatment of local and non-local self-energies. Here, I will argue that this is the case for the iron pnictide and chalcogenide superconductors. As an approach to tackle their electronic structure, I will detail the implementation of the recently proposed scheme that combines the quasi-particle self-consistent GW approach with dynamical mean-field theory: QSGW+DMFT. I will showcase the possibilities of QSGW+DMFT with an application on BaFe2As2. Further, I will discuss the empirical finding that in pnictides dynamical and non-local correlation effects separate within the quasi-particle band-width." @default.
- W3100884464 created "2020-11-23" @default.
- W3100884464 creator A5009832532 @default.
- W3100884464 date "2015-03-18" @default.
- W3100884464 modified "2023-09-26" @default.
- W3100884464 title "QS<i>GW</i>+DMFT: an electronic structure scheme for the iron pnictides and beyond" @default.
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- W3100884464 doi "https://doi.org/10.1088/1742-6596/592/1/012055" @default.
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