Nonlocal correlations in iron pnictides and chalcogenides

被引:20
|
作者
Bhattacharyya, Shinibali [1 ]
Bjornson, Kristofer [2 ]
Zantout, Karim [3 ]
Steffensen, Daniel [2 ]
Fanfarillo, Laura [1 ,4 ]
Kreisel, Andreas [5 ]
Valent, Roser [3 ]
Andersen, Brian M. [2 ]
Hirschfeld, P. J. [1 ]
机构
[1] Univ Florida, Dept Phys, Gainesville, FL 32611 USA
[2] Univ Copenhagen, Niels Bohr Inst, Lyngbyvej 2, DK-2100 Copenhagen, Denmark
[3] Goethe Univ, Inst Theoret Phys, D-60438 Frankfurt, Germany
[4] Scuola Int Super Studi Avanzati, SISSA, Via Bonomea 265, I-34136 Trieste, Italy
[5] Univ Leipzig, Inst Theoret Phys, D-04103 Leipzig, Germany
关键词
Iron compounds;
D O I
10.1103/PhysRevB.102.035109
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Deviations of low-energy electronic structurse of iron-based superconductors from density-functional-theory predictions have been parametrized in terms of band- and orbital-dependent mass renormalizations and energy shifts. The former have typically been described in terms of a local self-energy within the framework of dynamical mean field theory, while the latter appears to require nonlocal effects due to interband scattering. By calculating the renormalized band structure in both random phase approximation (RPA) and the two-particle self-consistent approximation (TPSC), we show that correlations in pnictide systems like LaFeAsO and LiFeAs can be described rather well by a nonlocal self-energy. In particular, Fermi pocket shrinkage as seen in experiments occurs due to repulsive interband finite-energy scattering. For the canonical iron chalcogenide system FeSe in its bulk tetragonal phase, the situation is, however, more complex since even including momentum-dependent band renormalizations cannot explain experimental findings. We propose that the nearest-neighbor Coulomb interaction may play an important role in band-structure renormalization in FeSe. We further compare our evaluations of nonlocal quasiparticle scattering lifetime within RPA and TPSC with experimental data for LiFeAs.
引用
收藏
页数:12
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