journal article·2022-05-20Open access

Kuramoto synchronization of quantum tunneling polarons for describing the dynamic structure in cuprate superconductors

Victor Velasco, Marcello B. Silva Neto, Andrea Perali, Sandro Wimberger, Alan R. Bishop, Steven D. Conradson

Physical Review B· Volume 105· Issue 17

Abstract

A major open topic in cuprates is the interplay between the lattice and electronic dynamics and the importance of their coupling to the mechanism of high-temperature superconductivity (HTSC). As evidenced by extended x-ray absorption fine structure (EXAFS) experiments, anharmonic structural effects are correlated with the charge dynamics and the transition to a superconducting phase in different HTSC compounds. Here we describe how structural anharmonic effects can be coupled to electronic and lattice dynamics in cuprate systems by performing the exact diagonalization of a prototype anharmonic many-body Hamiltonian on a relevant 6-atom cluster and show that the EXAFS results can be understood as a Kuramoto synchronization transition between coupled internal quantum tunneling of polarons associated with the two-site distribution of the copper--apical oxygen ($\mathrm{Cu}\text{\ensuremath{-}}{\mathrm{O}}_{\mathrm{ap}}$) pair in the dynamic structure. The transition is driven by the anharmonicity of the lattice vibrations and promotes the pumping of charge, initially stored at the apical oxygen reservoirs, into the copper-oxide plane. Simultaneously, a finite projection of the internal quantum tunneling polaron extends to the copper--planar oxygen ($\mathrm{Cu}\text{\ensuremath{-}}{\mathrm{O}}_{\mathrm{pl}}$) pair. All these findings allow an interpretation based on an effective quantum-mechanical triple-well potential associated with the oxygen sites of the 6-atom cluster, which accurately represents the phase synchronization of apical oxygens and lattice-assisted charge transfer to the ${\mathrm{CuO}}2$ plane.
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Research context

OpenAlex topics: Physics of Superconductivity and Magnetism · Advanced Condensed Matter Physics · Theoretical and Computational Physics

SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.

Affiliations

Instituto de Fisica, Universidade Federal do Rio de Janeiro, Caixa Postal 68528, Rio de Janeiro, Brazil

School of Pharmacy, Physics Unit, Università di Camerino, Via Madonna delle Carceri 9, 62032 Camerino, Italy

Dipartimento di Scienze Matematiche, Fisiche, e Informatiche, Università di Parma, 43124 Parma, Italy

INFN, Sezione di Milano Bicocca, Gruppo Collegato di Parma, 43124 Parma, Italy

Center for Nonlinear Studies, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, USA

Department of Complex Matter, Josef Stefan Institute, 1000 Ljubljana, Slovenia

Department of Chemistry, Washington State University, Pullman, Washington 90164, USA

Funding

Javna Agencija za Raziskovalno Dejavnost RS · National Science Foundation · U.S. Department of Energy · Office of Science · Basic Energy Sciences · Coordenação de Aperfeiçoamento de Pessoal de Nível Superior · Fundação Carlos Chagas Filho de Amparo à Pesquisa do Estado do Rio de Janeiro

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