English

Extended Falicov-Kimball model: Exact solution for finite temperatures

Strongly Correlated Electrons 2019-06-26 v2 Other Condensed Matter Statistical Mechanics Computational Physics

Abstract

The extended Falicov-Kimball model is analyzed exactly for finite temperatures (T0T\geq0) in the limit of large dimensions. Onsite and intersite density-density interactions UU and VV are included in the model. Using the dynamical mean field theory formalism on the Bethe lattice we find rigorously the temperature dependent density of states (DOS) at half-filling. At T=0T=0 the system is ordered to form the checkerboard pattern and the DOS has the gap Δ(εF)>0\Delta(\varepsilon_F) > 0 at the Fermi level, if only U0U\neq 0 or V0V\neq 0. If U<0U <0 or U>2VU > 2V, two additional subbands develop inside the principal energy gap. They become wider with increasing TT and at a certain UU- and VV-dependent temperature TMIT_{MI} they join with each other at εF\varepsilon_F. Since above TMIT_{MI} the DOS is positive at εF\varepsilon_F, we interpret TMIT_{MI} as the transformation temperature from insulator to metal. Moreover, we show that if V0.54V\lesssim 0.54 then TMI=0T_{MI}=0 at two quasi-quantum critical points Ucr±U_{cr}^{\pm} (one positive and the other negative), whereas for V0.54V\gtrsim 0.54 there is only one negative UcrU^-_{cr}. Having calculated the temperature dependent DOS we study thermodynamic properties of the system starting from its free energy and then we construct the phase diagrams in the variables TT and UU for a few values of VV. Our calculations give that inclusion of the intersite coupling VV causes the finite temperature phase diagrams to become asymmetric with respect to a change of sign of UU. On these phase diagrams we detected stability regions of eight different kinds of ordered phases, where both charge-order and antiferromagnetism coexists (five of them are insulating and three are conducting) and three different nonordered phases (two of them are insulating and one is conducting). Moreover, both continuous and discontinuous transitions between various phases were found.

Keywords

Cite

@article{arxiv.1903.08092,
  title  = {Extended Falicov-Kimball model: Exact solution for finite temperatures},
  author = {Konrad Jerzy Kapcia and Romuald Lemański and Stanisław Robaszkiewicz},
  journal= {arXiv preprint arXiv:1903.08092},
  year   = {2019}
}

Comments

16 pages, 13 figures, 78 references; pdfReVTeX; submitted to Physical Review B. Changes: corrected typos, added Fig. 11 and its discussion in Section III B 4, added several references, results unchanged

R2 v1 2026-06-23T08:13:01.880Z