Theoretical Description of Pseudocubic Manganites
Abstract
A comprehensive theoretical model for the bulk manganite system La(Ca,Sr)MnO is presented. The model includes local and cooperative Jahn-Teller distortions and the on-site Coulomb and exchange interaction. The model is is solved in the single-site dynamical mean field approximation using a solver based on the semiclassical approximation. The model semi-quantitatively reproduces the observed phase diagram for the doping and implies that the manganites are in the strong coupling region but close to Mott insulator/metal phase boundary. The results establish a formalism for use in a broader range of calculations, for example on heterostructures.
Keywords
Cite
@article{arxiv.0808.0736,
title = {Theoretical Description of Pseudocubic Manganites},
author = {Chungwei Lin and Andrew. J. Millis},
journal= {arXiv preprint arXiv:0808.0736},
year = {2009}
}
Comments
14 figures, 34 pages, using the bandwidth obtained from LDA with the observed structure, and resulting in a better fit to data.