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We present details of a continuous-time quantum Monte-Carlo algorithm for the screened Hubbard-Froehlich bipolaron. We simulate the bipolaron in one dimension with arbitrary interaction range in the presence of Coulomb repulsion, computing…

Strongly Correlated Electrons · Physics 2009-08-04 J. P. Hague , P. E. Kornilovitch

Polaron and bipolaron formation in the Holstein-Hubbard model with harmonic confinement potential, relevant to quantum dot structures, is investigated in one to three dimensions by means of unbiased quantum Monte Carlo simulations. The…

Strongly Correlated Electrons · Physics 2007-06-13 Martin Hohenadler , Holger Fehske

We study the Coulomb-Fr\"ohlich model on a triangular lattice, looking in particular at states with angular momentum. We examine a simplified model of crab bipolarons with angular momentum by projecting onto the low energy subspace of the…

Strongly Correlated Electrons · Physics 2009-01-09 J. P. Hague , P. E. Kornilovitch , J. H. Samson , A. S. Alexandrov

We present a diagrammatic Monte Carlo study of the properties of the Hubbard-Holstein bipolaron on a two-dimensional square lattice. With a small Coulomb repulsion, U, and with increasing electron-phonon interaction, and when reaching a…

Strongly Correlated Electrons · Physics 2007-05-23 Alexandru Macridin , George. A. Sawatzky , Mark Jarrell

Various mechanisms have been put forward for cuprate superconductivity, which fit largely into two camps: spin-fluctuation and electron-phonon (el-ph) mechanisms. However, in spite of a large effort, electron-phonon interactions are not…

Superconductivity · Physics 2011-11-09 J. P. Hague , P. E. Kornilovitch , A. S. Alexandrov , J. H. Samson

Bipolaron formation in a two-dimensional lattice with harmonic confinement, representing a simplified model for a quantum dot, is investigated by means of quantum Monte Carlo simulations. This method treats all interactions exactly and…

Strongly Correlated Electrons · Physics 2007-10-25 Martin Hohenadler , Peter B Littlewood

Recent angle-resolved photoemission spectroscopy (ARPES) has identified that a finite-range Fr\"ohlich electron-phonon interaction (EPI) with c-axis polarized optical phonons is important in cuprate superconductors, in agreement with an…

Superconductivity · Physics 2007-06-13 J. P. Hague , P. E. Kornilovitch , J. H. Samson , A. S. Alexandrov

We employ the diagrammatic Monte Carlo method with a lattice path-integral formulation for both electron and phonon degrees of freedom to investigate the formation and properties of bond polarons and bipolarons on a two-dimensional…

Superconductivity · Physics 2025-07-11 Chao Zhang

The Rice-Sneddon model for BaBiO$_3$ is a nice model Hamiltonian for considering the properties of polarons and bipolarons in a three-dimensional oxide crystal. We use exact diagonalization methods on finite samples to study the stability…

Condensed Matter · Physics 2009-10-28 Vladimir N. Kostur , Philip B. Allen

We study a lattice bipolaron on a staggered triangular ladder and triangular and hexagonal lattices with both long-range electron-phonon interaction and strong Coulomb repulsion using a novel continuous-time quantum Monte-Carlo (CTQMC)…

Superconductivity · Physics 2009-11-11 J. P. Hague , P. E. Kornilovitch , J. H. Samson , A. S. Alexandrov

We use numerically exact quantum Monte Carlo (QMC) to compute the properties of three-dimensional bipolarons for interaction strengths where perturbation theory fails. For intermediate electron-phonon coupling and Hubbard U, we find that…

Strongly Correlated Electrons · Physics 2015-06-03 A. R. Davenport , J. P. Hague , P. E. Kornilovitch

We study the effective mass of the bipolarons and essentially the possibility to get both light and strongly bound bipolarons in the Holstein-Hubbard model and some variations in the vicinity of the adiabatic limit. Several approaches to…

Superconductivity · Physics 2009-10-31 Laurent Proville , Serge Aubry

We revisit the two-site Hubbard-Holstein model by using extended phonon coherent states. The nontrivial singlet bipolaron is studied exactly in the whole coupling regime. The ground-state (GS) energy and the double occupancy probability are…

Strongly Correlated Electrons · Physics 2015-05-13 Yu-Yu Zhang , Tao Liu , Qing-Hu Chen , Xiaoguang Wang , Kelin Wang

We use the Momentum Average approximation (MA) to study the ground-state properties of strongly bound bipolarons in the double-well electron-phonon (el-ph) coupling model, which describes certain intercalated lattices where the linear term…

Strongly Correlated Electrons · Physics 2015-06-19 Clemens PJ Adolphs , Mona Berciu

Electrons may form inter-site pairs (dimers) by a number of mechanisms. For example, long-range (Fr\"ohlich) electron-phonon interactions and strong on-site Hubbard U allow formation of small light bipolarons in some lattices. We identify…

Strongly Correlated Electrons · Physics 2011-06-01 S Jackson , J H Samson

An efficient continuous-time path-integral Quantum Monte Carlo algorithm for the lattice polaron is presented. It is based on Feynman's integration of phonons and subsequent simulation of the resulting single-particle self-interacting…

Strongly Correlated Electrons · Physics 2009-10-31 P E Kornilovitch

It is widely accepted that phonon-mediated high-temperature superconductivity is impossible at ambient pressure, because of the very large effective masses of polarons/bipolarons at strong electron-phonon coupling. Here we challenge this…

Superconductivity · Physics 2019-04-29 John Sous , Monodeep Chakraborty , Roman V. Krems , Mona Berciu

We report quantum Monte Carlo calculations of biexciton binding energies in ideal two-dimensional bilayer systems with isotropic electron and hole masses. We have also calculated exciton-exciton interaction potentials, and pair distribution…

Strongly Correlated Electrons · Physics 2010-02-10 R. M. Lee , N. D. Drummond , R. J. Needs

Bipolaron energies are calculated as a function of wave vector by a variational method of Gurari appropriate for weak or intermediate coupling strengths, for a model with electron-phonon interactions independent of phonon wave vectors and a…

Superconductivity · Physics 2009-11-11 D. M. Eagles , R. M. Quick , B. Schauer

We numerically and analytically calculate the properties of the bipolaron in an extended Hubbard Holstein model, which has a longer range electron-phonon coupling like the Fr\" ohlich model. In the strong coupling regime, the effective mass…

Strongly Correlated Electrons · Physics 2009-11-07 J. Bonca , S. A. Trugman
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