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Correlations tune the electronic structure of pentalayer nickelates into the superconducting regime

Paul Worm1, Liang Si2,1,*, Motoharu Kitatani3, Ryotaro Arita3,4, Jan M. Tomczak1, and Karsten Held1,†

  • 1Institute of Solid State Physics, TU Wien, 1040 Vienna, Austria
  • 2School of Physics, Northwest University, Xian 710127, China
  • 3RIKEN Center for Emergent Matter Sciences (CEMS), Wako, Saitama 351-0198, Japan
  • 4Department of Applied Physics, The University of Tokyo, Hongo, Tokyo 113-8656, Japan

  • *liang.si@ifp.tuwien.ac.at
  • †held@ifp.tuwien.ac.at

Intermediate ground states of hydrogen in LaNiO2 : A first-principles study

Xiangru Han, Pei Li, Xuelei Sui, Heng Jin, Feng Luo, Liang Qiao, and Bing Huang

Phys. Rev. B 108 165145 (2023)

Electronic correlations and superconducting instability in La3Ni2O7 under high pressure

Frank Lechermann, Jannik Gondolf, Steffen Bötzel, and Ilya M. Eremin

Phys. Rev. B 108 L201121 (2023)

Topotactic hydrogen forms chains in ABO2 nickelate superconductors

Liang Si, Paul Worm, Dachuan Chen, and Karsten Held

Phys. Rev. B 107 165116 (2023)

Origin of superconductivity in hole doped SrBiO3 bismuth oxide perovskite from parameter-free first-principles simulations

Julien Varignon

npj Comput Mater 9 30 (2023)

Ab initio materials design of superconductivity in d9 nickelates

Motoharu Kitatani, Yusuke Nomura, Motoaki Hirayama, and Ryotaro Arita

APL Materials 11 030701 (2023)

Phase formation in hole- and electron-doped rare-earth nickelate single crystals

P. Puphal, V. Sundaramurthy, V. Zimmermann, K. Küster, U. Starke, M. Isobe, B. Keimer, and M. Hepting

APL Materials 11 081107 (2023)

Many-body electronic structure of d9−δ layered nickelates

Harrison LaBollita, Myung-Chul Jung, and Antia S. Botana

Phys. Rev. B 106 115132 (2022)

Spin density wave, charge density wave, and bond disproportionation wave instabilities in hole-doped infinite-layer RNiO2

K. G. Slobodchikov and I. V. Leonov

Phys. Rev. B 106 165110 (2022)

Fingerprints of Topotactic Hydrogen in Nickelate Superconductors

Liang Si, Paul Worm, and Karsten Held

Crystals 12 656 (2022)

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