Quantum Monte Carlo Study of the One Dimensional Extended Hubbard Model with Long Range Electron-Phonon Coupling

Recent studies of pairing and charge order in materials such as FeSe, SrTiO$_3$, and 2H-NbSe$_2$ have suggested that momentum dependence of the electron-phonon coupling plays an important role in their properties. Initial attempts to study Hamiltonians which either do not include or else truncate the range of Coulomb repulsion have noted that the resulting spatial non-locality of the electron-phonon interaction leads to a dominant tendency to phase separation. Here we present Quantum Monte Carlo results for such models in which we incorporate both on-site and intersite electron-electron interactions. We show that these can stabilize phases in which the density is homogeneous and determine the associated phase boundaries. As a consequence, the physics of momentum dependent electron-phonon coupling can be determined outside of the trivial phase separated regime.

[1]  S. Sorella,et al.  Superconductivity, charge-density waves, antiferromagnetism, and phase separation in the Hubbard-Holstein model , 2017, 1709.00278.

[2]  H. Fehske,et al.  Effect of electron-phonon interaction range for a half-filled band in one dimension. , 2012, Physical review letters.

[3]  A. Lebed The Physics of Organic Superconductors and Conductors , 2008 .

[4]  R. T. Clay,et al.  Phase diagram of the one-dimensional Hubbard-Holstein model at half and quarter filling , 2006, cond-mat/0612273.

[5]  A. Neto,et al.  Retardation effects in the Holstein-Hubbard chain at half filling , 2006, cond-mat/0607700.

[6]  D. Campbell,et al.  Functional renormalization group analysis of the half-filled one-dimensional extended Hubbard model. , 2005, Physical review letters.

[7]  R. T. Clay,et al.  Intermediate phase of the one dimensional half-filled Hubbard-Holstein model. , 2005, Physical review letters.

[8]  Matthias Troyer,et al.  Computational complexity and fundamental limitations to fermionic quantum Monte Carlo simulations , 2004, Physical review letters.

[9]  P. Kornilovitch,et al.  Effect of electron-phonon interaction range on lattice polaron dynamics: A continuous-time quantum Monte Carlo study , 2004, cond-mat/0407250.

[10]  A. R. Bishop,et al.  Quantum lattice dynamical effects on single-particle excitations in one-dimensional Mott and Peierls insulators , 2003, cond-mat/0312426.

[11]  A. Alexandrov,et al.  Small adiabatic polaron with a long-range electron-phonon interaction , 2003, cond-mat/0309061.

[12]  Chunli Zhang,et al.  METAL-INSULATOR TRANSITION IN THE ONE-DIMENSIONAL HOLSTEIN MODEL AT HALF FILLING , 1999, cond-mat/9903149.

[13]  A. J. Berlinsky One-dimensional metals and charge density wave effects in these materials , 1979 .