Do you want to publish a course? Click here

Diagrammatic quantum Monte Carlo study of an acoustic lattice polaron

123   0   0.0 ( 0 )
 Added by Thomas Hahn
 Publication date 2021
  fields Physics
and research's language is English




Ask ChatGPT about the research

We present the first approximation free diagrammatic Monte Carlo study of a lattice polaron interacting with an acoustic phonon branch through the deformation potential. Weak and strong coupling regimes are separated by a self-trapping region where quantum resonance between various possible lattice deformations is seen in the ground state properties, spectral function, and optical conductivity. The unique feature of such polaron is the interplay between long- and short wavelength acoustic vibrations creating a composite phonon cloud and leading to persistent self-trapping due to the existence of multiple quasi-stable states. This results in a spectral response whose structure is much more complex than in any of the previously considered polaron models.



rate research

Read More

We consider two large polaron systems that are described by a Fr{o}hlich type of Hamiltonian, namely the Bose-Einstein condensate (BEC) polaron in the continuum and the acoustic polaron in a solid. We present ground-state energies of these two systems calculated with the Diagrammatic Monte Carlo (DiagMC) method and with a Feynman all-coupling approach. The DiagMC method evaluates up to very high order a diagrammatic series for the polaron Greens function. The Feynman all-coupling approach is a variational method that has been used for a wide range of polaronic problems. For the acoustic and BEC polaron both methods provide remarkably similar non-renormalized ground-state energies that are obtained after introducing a finite momentum cutoff. For the renormalized ground-state energies of the BEC polaron, there are relatively large discrepancies between the DiagMC and the Feynman predictions. These differences can be attributed to the renormalization procedure for the contact interaction.
Exciton-polaron formation in one-dimensional lattice models with short or long-range carrier-phonon interaction is studied by quantum Monte Carlo simulations. Depending on the relative sign of electron and hole-phonon coupling, the exciton-polaron size increases or decreases with increasing interaction strength. Quantum phonon fluctuations determine the (exciton-)polaron size and yield translation-invariant states at all finite couplings.
102 - T. Hahn , S. Klimin , J. Tempere 2018
We present results for the solution of the large polaron Frohlich Hamiltonian in 3-dimensions (3D) and 2-dimensions (2D) obtained via the Diagrammatic Monte Carlo (DMC) method. Our implementation is based on the approach by Mishchenko [A.S. Mishchenko et al., Phys. Rev. B 62, 6317 (2000)]. Polaron ground state energies and effective polaron masses are successfully benchmarked with data obtained using Feynmans path integral formalism. By comparing 3D and 2D data, we verify the analytically exact scaling relations for energies and effective masses from 3D$to$2D, which provides a stringent test for the quality of DMC predictions. The accuracy of our results is further proven by providing values for the exactly known coefficients in weak- and strong coupling expansions. Moreover, we compute polaron dispersion curves which are validated with analytically known lower and upper limits in the small coupling regime and verify the first order expansion results for larger couplings, thus disproving previous critiques on the apparent incompatibility of DMC with analytical results and furnishing useful reference for a wide range of coupling strengths.
We propose a novel approach to nonequilibrium real-time dynamics of quantum impurities models coupled to biased non-interacting leads, such as those relevant to quantum transport in nanoscale molecular devices. The method is based on a Diagrammatic Monte Carlo sampling of the real-time perturbation theory along the Keldysh contour. We benchmark the method on a non-interacting resonant level model and, as a first non-trivial application, we study zero temperature non-equilibrium transport through a vibrating molecule.
We study the effects of anharmonicity on the physics of the Holstein model, which describes the coupling of itinerant fermions and localized quantum phonons, by introducing a quartic term in the phonon potential energy. We find that the presence of this anharmonic term reduces the extent of the charge density wave phase (CDW) at half-filling as well as the transition temperature to this phase. Doping away from half-filling, we observe a first order phase transition between the CDW and a homogeneous phase which is also present in the harmonic model. In addition, we study the evolution of the superconducting susceptibility in the doped region and show that anharmonicity can enhance the superconducting response.
comments
Fetching comments Fetching comments
Sign in to be able to follow your search criteria
mircosoft-partner

هل ترغب بارسال اشعارات عن اخر التحديثات في شمرا-اكاديميا