Effects of electron correlation, orbital degeneracy and Jahn-Teller coupling in perovskite manganites

Citation
Y. Motome et M. Imada, Effects of electron correlation, orbital degeneracy and Jahn-Teller coupling in perovskite manganites, J PHYS JPN, 68(1), 1999, pp. 16-19
Citations number
53
Categorie Soggetti
Physics
Journal title
JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
ISSN journal
00319015 → ACNP
Volume
68
Issue
1
Year of publication
1999
Pages
16 - 19
Database
ISI
SICI code
0031-9015(199901)68:1<16:EOECOD>2.0.ZU;2-Y
Abstract
Roles of Coulomb interaction, orbital degeneracy and Jahn-Teller coupling i n double-exchange models are examined for perovskite Mn oxides. We study th e undoped insulator as well as metal-insulator transitions by hole doping, and especially strong incoherence of ferromagnetic metal. We derive models where all the spins are fully polarized in two-dimensional planes as indica ted by experimental results, and investigate their ground-state properties by the quantum Monte Carlo method. At half filling where the number of e(q) electrons is one per site on average, the Coulomb interaction opens a Mott gap and induces a staggered orbital ordering. The opening of the gap is, h owever, substantially slower than the mean-field results if the Jahn-Teller coupling is absent. The synergy between the strong correlation and the Jah n-Teller coupling largely enhances the charge gap amplitude and reproduces realistic amplitudes and stabilization energy of the Jahn-Teller distortion . Doping of carriers destroys the orbital ordering stabilized by the Coulom b interaction. The short-ranged orbital correlation is critically enhanced in metals toward the metal-insulator transition, which should be related to the strong incoherence of charge dynamics observed in experiments. Our mod el, moreover exhibits a uniform ordering of d(x)2(-y)2 orbitals over a wide region of doping in agreement with experimental indications.