129 citations · 257 across the 3 of their papers we have counts for
7 papers · 1 filter
Pressure-Driven Metal-Insulator Transition in Hematite from Dynamical Mean-Field Theory
J. Kunes, Dm. M. Korotin, M. A. Korotin +2
The Local Density Approximation combined with Dynamical Mean-Field Theory (LDA+DMFT method) is applied to the study of the paramagnetic and magnetically ordered phases of hematite…
Coulomb repulsion and correlation strength in LaFeAsO from Density Functional and Dynamical Mean-Field Theories
V. I. Anisimov, Dm. M. Korotin, M. A. Korotin +5
LDA+DMFT (Local Density Approximation combined with Dynamical Mean-Field Theory) computation scheme has been used to calculate spectral properties of LaFeAsO -- the parent compound…
Coulomb Parameter U and Correlation Strength in LaFeAsO
V. I. Anisimov, Dm. M. Korotin, S. V. Streltsov +4
First principles constrained density functional theory scheme in Wannier functions formalism has been used to calculate Coulomb repulsion U and Hund's exchange J parameters for iro…
Coulomb correlation effects in LaOFeAs: LDA+DMFT(QMC) study
A. O. Shorikov, M. A. Korotin, S. V. Streltsov +3
Effects of Coulomb correlation on LaOFeAs electronic structure have been investigated by LDA+DMFT(QMC) method. The calculation results show that LaOFeAs is in the regime of interme…
Structural relaxation due to electronic correlations in the paramagnetic insulator KCuF3
I. Leonov, N. Binggeli, Dm. Korotin +3
A computational scheme for the investigation of complex materials with strongly interacting electrons is formulated which is able to treat atomic displacements, and hence structura…
Construction and solution of a Wannier-functions based Hamiltonian in the pseudopotential plane-wave framework for strongly correlated materials
Dm. Korotin, A. V. Kozhevnikov, S. L. Skornyakov +4
Ab initio determination of model Hamiltonian parameters for strongly correlated materials is a key issue in applying many-particle theoretical tools to real narrow-band materials.…