Hole doping and electronic correlations in Cr substituted BaFe$_{2}$As$_{2}$
Marli dos Reis Cantarino, Kevin R. Pakuszewski, Bjoern Salzmann, Pedro H. A. Moya, Wagner R. da Silva Neto, Gabriel S. Freitas, Pascoal G. Pagliuso, Cris Adriano, Walber H. Brito, Fernando A. Garcia
SciPost Phys. 17, 141 (2024) · published 22 November 2024
- doi: 10.21468/SciPostPhys.17.5.141
- Submissions/Reports
Abstract
For a significant composition range, the suppression of the spin density wave transition temperature ($T_{\text{SDW}}$) in Cr- and Mn-substituted BaFe$_{2}$As$_{2}$ (CrBFA and MnBFA, respectively) coincides as a function of Cr/Mn content, despite the distinct electronic effects of these substitutions. Additionally, for any Cr/Mn content superconductivity (SC) is absent and this topic is particularly less explored in the case of CrBFA. In this work, we employ angle-resolved photoemission spectroscopy (ARPES) and combined density functional theory plus dynamical mean field theory (DFT+DMFT) to address the evolution of the Fermi surface (FS) and electronic correlations in CrBFA. Our findings reveal that incorporating Cr leads to an effective hole doping of the states near the FS, which is well described within the virtual crystal approximation (VCA). Moreover, analysis of the ARPES spectra of the bands with main $d_{yz}$-orbital character reveals a fractional scaling of the imaginary part of self-energy as a function of the binding energy, a signature property of Hund's correlations. Our DFT+DMFT calculations support these experimental findings. We conclude that CrBFA is a correlated electron system for which the changes in the FS as a function of Cr are unrelated to the suppression of $T_{\text{SDW}}$. In addition, we suggest that the absence of SC is primarily due to the competition between Cr local moments and the Fe-derived itinerant spin fluctuations.
Authors / Affiliations: mappings to Contributors and Organizations
See all Organizations.- 1 2 Marli dos Reis Cantarino,
- 3 Kevin R. Pakuszewski,
- 4 Bjoern Salzmann,
- 1 Pedro H. A. Moya,
- 1 Wagner R. da Silva Neto,
- 3 Gabriel S. Freitas,
- 3 Pascoal G. Pagliuso,
- 3 Cris Adriano,
- 5 Walber H. Brito,
- 1 6 7 Fernando A. Garcia
- 1 Universidade de São Paulo / University of Sao Paulo [USP]
- 2 European Synchrotron Radiation Facility [ESRF]
- 3 Universidade Estadual de Campinas / State University of Campinas [UNICAMP]
- 4 Université de Fribourg / University of Fribourg
- 5 Université fédérale du minas gerais / Universidade Federal de Minas Gerais [UFMG]
- 6 Iowa State University [ISU]
- 7 Ames Laboratory
- Conselho Nacional de Desenvolvimento Científico e Tecnológico / National Council for Scientific and Technological Development [CNPq]
- Fundação de Amparo à Pesquisa do Estado de Minas Gerais
- Fundação de Amparo à Pesquisa do Estado de São Paulo / São Paulo Research Foundation [FAPESP]
- Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung / Swiss National Science Foundation [SNF]
- United States Department of Energy [DOE]