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One-Fe versus Two-Fe Brillouin Zone of Fe-Based Superconductors: Creation of the Electron Pockets by Translational Symmetry Breaking

Chia-Hui Lin, Tom Berlijn, Limin Wang, Chi-Cheng Lee, Wei-Guo Yin, Wei Ku

DOI 10.1103/PhysRevLett.107.257001 · Physical Review Letters

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Abstract

We investigate the physical effects of translational symmetry breaking in Fe-based high-temperature superconductors due to alternating anion positions. In the representative parent compounds, including the newly discovered Fe-vacancy-ordered K0.8Fe1.6Se2, an unusual change of orbital character is found across the one-Fe Brillouin zone upon unfolding the first-principles band structure and Fermi surfaces, suggesting that covering a larger one-Fe Brillouin zone is necessary in experiments. Most significantly, the electron pockets (critical to the magnetism and superconductivity) are found only created with broken symmetry, advocating strongly its full inclusion in future studies, particularly on the debated nodal structures of the superconducting order parameter.

Source-reported materials — not catalogue approval

FormulaReported Tc (K)Pressure (GPa)Type
K0.8Fe1.6Se2

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—Pressure not reportedunknown
BaFe2As2

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Source-occurrence policy only; no material identity or catalogue acceptance is inferred from the formula.

—Pressure not reportedunknown
Bi2Sr2CaCu2O8+δ

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Source-occurrence policy only; no material identity or catalogue acceptance is inferred from the formula.

—Pressure not reportedunknown

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