A. Lamagna et R. Pucci, EFFECTIVE ELECTRON HAMILTONIAN FOR A QUASI-ONE-DIMENSIONAL SYSTEM - THE (TMTSF)(2)X AND THE (TMTTF)(2)X SYSTEMS, The European Physical Journal. B: Condensed Matter Physics, 4(4), 1998, pp. 421-429
In this paper we have introduced a variational approach to investigate
the ground state of a model which includes both the Holstein electron
-phonon interaction and the extended Hubbard electron-electron interac
tion. We have considered a variational state for the phonon subsystem
which generalizes the previous used forms. This state allows to take i
nto account the possibility of extended phonon mediated correlations.
The effective electron Hamiltonian, which we have obtained, includes f
irst and second neighbor electron-electron interaction terms. We have
treated exactly, through a Lanczos method, this effective model in the
one-dimensional case. We have applied our method to two Bechgaard sal
ts and in these cases we have estimated the correlation parameters. We
have shown that the introduction of electron-phonon interaction allow
s an estimate of the on site U and nearest-neighbor V Coulomb repulsio
n, which are in agreement with the experimental optical spectra of the
above mentioned two compounds.