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Orbital localization and the role of the Fe and As 4p orbitals in BaFe2As2 probed by XANES

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A. G. de Figueiredo1, M. R. Cantarino1, W. R. da Silva Neto1,2, K. R. Pakuszewski3, R. Grossi3, D. S. Christovam3∗, J. C. Souza3, M. M. Piva3∗, G. S. Freitas3, P.… Click to show full abstract

A. G. de Figueiredo1, M. R. Cantarino1, W. R. da Silva Neto1,2, K. R. Pakuszewski3, R. Grossi3, D. S. Christovam3∗, J. C. Souza3, M. M. Piva3∗, G. S. Freitas3, P. G. Pagliuso3, C. Adriano3, F. A. Garcia1 1Instituto de Física, Universidade de São Paulo, São Paulo-SP, 05508-090, Brazil 2Instituto de Química, Universidade de São Paulo, São Paulo-SP, 05508-090, Brazil and 3Inst Fis Gleb Wataghin, Universidade Estadual de Campinas, Campinas-SP, 13083-859, Brazil∗

Keywords: orbitals bafe2as2; probed xanes; localization role; role orbitals; orbital localization; bafe2as2 probed

Journal Title: Physical Review B
Year Published: 2022

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