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Towards realistic electronic structure calculations of strongly correlated electron systems
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cond-mat.str-elcond-mat.mtrl-sci
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calculationsrealisticapproachaspectscoefficientscorrelateddensitydriven
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We review some aspects of the realistic implementation of the dynamical mean-field method. We extend the techniques introduced in Ref.[A. Georges, G. Kotliar, W. Krauth, and M.J. Rozenberg, Rev. Mod. Phys. 68, 13 (1996)] to include the calculations of transport coefficients. The approach is illustrated on La_{1-x}Sr_xTiO_3 material undergoing a density driven Mott transition.
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