Phase diagrams and two key factors to superconductivity of Ruddlesden-Popper nickelates

Fuente: arXiv
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Autori principali: Ouyang, Zhenfeng, He, Rong-Qiang, Lu, Zhong-Yi
Natura: Preprint
Pubblicazione: 2025
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author Ouyang, Zhenfeng
He, Rong-Qiang
Lu, Zhong-Yi
author_facet Ouyang, Zhenfeng
He, Rong-Qiang
Lu, Zhong-Yi
contents The discovery of superconductivity in Ruddlesden-Popper (RP) nickelates has drawn great attention. Many works have been done to study the superconductivity as well as to find more superconducting RP nickelates. However, there is a lack of general understanding regarding the key factors that contribute to the superconductivity of RP nickelates. Here, we systematically study the series of RP nickelates under doping or high-pressure conditions by means of density functional theory plus dynamical mean-field theory. We find that enhanced quasi-particle weights and local spin fluctuation of the Ni-$e_g$ orbitals are commonly realized by hole doping or high pressure in the known superconducting RP nickelates, suggesting that they are crucial to the superconductivity. We also summarize experimentally synthesized RP nickelates into phase diagrams with local spin moment and local entanglement entropy as parameters, where phases of spin density wave/antiferromagnetism, superconductivity, and Fermi liquid are distinguished. At last, we predict a promising candidate for superconducting RP nickelates, which is constructed in a ``bilayer-trilayer'' stacking sequence.
format Preprint
id arxiv_https___arxiv_org_abs_2503_08682
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Phase diagrams and two key factors to superconductivity of Ruddlesden-Popper nickelates
Ouyang, Zhenfeng
He, Rong-Qiang
Lu, Zhong-Yi
Superconductivity
Strongly Correlated Electrons
The discovery of superconductivity in Ruddlesden-Popper (RP) nickelates has drawn great attention. Many works have been done to study the superconductivity as well as to find more superconducting RP nickelates. However, there is a lack of general understanding regarding the key factors that contribute to the superconductivity of RP nickelates. Here, we systematically study the series of RP nickelates under doping or high-pressure conditions by means of density functional theory plus dynamical mean-field theory. We find that enhanced quasi-particle weights and local spin fluctuation of the Ni-$e_g$ orbitals are commonly realized by hole doping or high pressure in the known superconducting RP nickelates, suggesting that they are crucial to the superconductivity. We also summarize experimentally synthesized RP nickelates into phase diagrams with local spin moment and local entanglement entropy as parameters, where phases of spin density wave/antiferromagnetism, superconductivity, and Fermi liquid are distinguished. At last, we predict a promising candidate for superconducting RP nickelates, which is constructed in a ``bilayer-trilayer'' stacking sequence.
title Phase diagrams and two key factors to superconductivity of Ruddlesden-Popper nickelates
topic Superconductivity
Strongly Correlated Electrons
url https://arxiv.org/abs/2503.08682