We present results for the solution of the large polaron Fröhlich 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 Feynman's path integral formalism. By comparing 3D and 2D data, we verify the analytically exact scaling relations for energies and effective masses from 3D→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.

Diagrammatic Monte Carlo study of Fröhlich polaron dispersion in two and three dimensions / Klimin, Sergei; Tempere, Jacques; Devreese, Jozef T.; Franchini, Cesare; Hahn, Thomas. - In: PHYSICAL REVIEW. B. - ISSN 2469-9969. - STAMPA. - 97:13(2018), pp. 1-9. [10.1103/PhysRevB.97.134305]

Diagrammatic Monte Carlo study of Fröhlich polaron dispersion in two and three dimensions

Franchini, Cesare
Supervision
;
2018

Abstract

We present results for the solution of the large polaron Fröhlich 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 Feynman's path integral formalism. By comparing 3D and 2D data, we verify the analytically exact scaling relations for energies and effective masses from 3D→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.
2018
Diagrammatic Monte Carlo study of Fröhlich polaron dispersion in two and three dimensions / Klimin, Sergei; Tempere, Jacques; Devreese, Jozef T.; Franchini, Cesare; Hahn, Thomas. - In: PHYSICAL REVIEW. B. - ISSN 2469-9969. - STAMPA. - 97:13(2018), pp. 1-9. [10.1103/PhysRevB.97.134305]
Klimin, Sergei; Tempere, Jacques; Devreese, Jozef T.; Franchini, Cesare; Hahn, Thomas
File in questo prodotto:
Eventuali allegati, non sono esposti

I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.

Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11585/662424
 Attenzione

Attenzione! I dati visualizzati non sono stati sottoposti a validazione da parte dell'ateneo

Citazioni
  • ???jsp.display-item.citation.pmc??? ND
  • Scopus 24
  • ???jsp.display-item.citation.isi??? 22
social impact