NEW PHASES IN AN EXTENDED HUBBARD-MODEL EXPLICITLY INCLUDING ATOMIC POLARIZABILITIES

Citation
J. Vandenbrink et al., NEW PHASES IN AN EXTENDED HUBBARD-MODEL EXPLICITLY INCLUDING ATOMIC POLARIZABILITIES, Physical review letters, 75(25), 1995, pp. 4658-4661
Citations number
20
Categorie Soggetti
Physics
Journal title
ISSN journal
00319007
Volume
75
Issue
25
Year of publication
1995
Pages
4658 - 4661
Database
ISI
SICI code
0031-9007(1995)75:25<4658:NPIAEH>2.0.ZU;2-9
Abstract
We consider the influence of a nearest-neighbor Coulomb interaction in an extended Hubbard model and introduce a new interaction term which simulates atomic polarizabilities. This has the effect of screening th e on-site Coulomb interaction for charged excitations, unlike a neighb or Coulomb interaction which reduces energies of locally neutral excit ations. We find that the spin density to charge density wave phase tra nsition, however, is determined by the unscreened on-site Coulomb repu lsion. The order of this phase transition is affected by polarization. We show that new phases appear, one of which is ferroelectric, when a tomic polarizabilities are explicitly included.