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Momentum-resolved spectral functions of SrVO calculated by LDA+DMFT
I. A. Nekrasov, K. Held, G. Keller +6
LDA+DMFT, the merger of density functional theory in the local density approximation and dynamical mean-field theory, has been mostly employed to calculate k-integrated spectra acc…
Explanation of the similarity of the experimental photoemission spectra of SrVO3 and CaVO3
I. A. Nekrasov, G. Keller, D. E. Kondakov +5
We present parameter-free LDA+DMFT results for the many-particle density of states of cubic SrVO3 and orthorhombic CaVO3. Both systems are found to be strongly correlated metals, b…
Localization in ruthenates: magnetic and electronic properties of Ca(2-x)Sr(x)RuO(4)
V. I. Anisimov, I. A. Nekrasov, D. E. Kondakov +2
The electronic structures of the metallic and insulating phases of Ca(2-x)Sr(x)RuO(4) (0<= x <= 2) are calculated using LDA, LDA+U and Dynamical Mean-Field Approximation methods. F…