Structural transitions, octahedral rotations, and electronic properties of A 3Ni2O7 rare-earth nickelates under high pressure
Abstract Motivated by the recent observation of superconductivity with T c ~ 80 K in pressurized La3Ni2O7 1, we explore the structural and electronic properties of A 3Ni2O7 bilayer nickelates (A = La-Lu, Y, Sc) as a function of pressure (0–150 GPa) from first principles including a Coulomb repulsio...
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| 主要な著者: | , , , , |
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| フォーマット: | Artigo |
| 言語: | Inglês |
| 出版事項: |
Nature Portfolio
2024-04-01
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| シリーズ: | npj Quantum Materials |
| オンライン･アクセス: | https://doi.org/10.1038/s41535-024-00648-0 |
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