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• W3135877900 endingPage "4433" @default.
• W3135877900 startingPage "4424" @default.
• W3135877900 abstract "A polycrystalline sample of Tl2Ir2O7 was synthesized by high-pressure and high-temperature methods. Tl2Ir2O7 crystallizes in the cubic pyrochlore structure with space group Fd3̅m (No. 227). The Ir4+ oxidation state is confirmed by Ir–L3 X-ray absorption near-edge spectroscopy. Combined temperature-dependent magnetic susceptibility, resistivity, specific heat, and DFT+DMFT calculation data show that Tl2Ir2O7 is a Pauli paramagnetic metal, but it is close to a metal–insulator transition. The effective ionic size of Tl3+ is much smaller than that of Pr3+ in metallic Pr2Ir2O7; hence, Tl2Ir2O7 would be expected to be insulating according to the established phase diagram of the pyrochlore iridate compounds, A3+2Ir4+2O7. Our experimental and theoretical studies indicate that Tl2Ir2O7 is uniquely different from the current A3+2Ir4+2O7 phase diagram. This uniqueness is attributed primarily to the electronic configuration difference between Tl3+ and rare-earth ions, which plays a substantial role in determining the Ir–O–Ir bond angle, and the corresponding electrical and magnetic properties." @default.
• W3135877900 created "2021-03-15" @default.
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• W3135877900 date "2021-03-11" @default.
• W3135877900 modified "2023-10-16" @default.
• W3135877900 title "Tl₂Ir₂O₇: A Pauli Paramagnetic Metal, Proximal to a Metal Insulator Transition" @default.
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• W3135877900 doi "https://doi.org/10.1021/acs.inorgchem.0c03124" @default.
• W3135877900 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/33705141" @default.
• W3135877900 hasPublicationYear "2021" @default.
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