Strong correlations from Hund's coupling
Strong electronic correlations are often associated with the proximity of a Mott-insulating
state. In recent years however, it has become increasingly clear that the Hund's rule …
state. In recent years however, it has become increasingly clear that the Hund's rule …
Electronic structure calculations with dynamical mean-field theory
A review of the basic ideas and techniques of the spectral density-functional theory is
presented. This method is currently used for electronic structure calculations of strongly …
presented. This method is currently used for electronic structure calculations of strongly …
Electronic structure calculations using dynamical mean field theory
K Held - Advances in physics, 2007 - Taylor & Francis
The calculation of the electronic properties of materials is an important task of solid-state
theory, albeit particularly difficult if electronic correlations are strong, eg, in transition metals …
theory, albeit particularly difficult if electronic correlations are strong, eg, in transition metals …
High-spin to low-spin and orbital polarization transitions in multiorbital Mott systems
We study the interplay of crystal field splitting and Hund coupling in a two-orbital model
which captures the essential physics of systems with two electrons or holes in the eg shell …
which captures the essential physics of systems with two electrons or holes in the eg shell …
Dynamical mean-field theory using Wannier functions: A flexible route to electronic structure calculations of strongly correlated materials
F Lechermann, A Georges, A Poteryaev… - Physical Review B …, 2006 - APS
A versatile method for combining density functional theory in the local density approximation
with dynamical mean-field theory (DMFT) is presented. Starting from a general basis …
with dynamical mean-field theory (DMFT) is presented. Starting from a general basis …
Coulomb correlations in 4d and 5d oxides from first principles—or how spin–orbit materials choose their effective orbital degeneracies
C Martins, M Aichhorn, S Biermann - Journal of Physics …, 2017 - iopscience.iop.org
The interplay of spin–orbit coupling and Coulomb correlations has become a hot topic in
condensed matter theory and is especially important in 4d and 5d transition metal oxides …
condensed matter theory and is especially important in 4d and 5d transition metal oxides …
Asymmetry in band widening and quasiparticle lifetimes in : Competition between screened exchange and local correlations from combined and dynamical …
JM Tomczak, M Casula, T Miyake, S Biermann - Physical Review B, 2014 - APS
The very first dynamical implementation of the combined GW and dynamical mean-field
scheme “GW+ DMFT” for a real material was achieved recently [Tomczak, Europhys. Lett …
scheme “GW+ DMFT” for a real material was achieved recently [Tomczak, Europhys. Lett …
Evolution of the Fermi Surface and Quasiparticle Renormalization <?format ?>through a van Hove Singularity in
KM Shen, N Kikugawa, C Bergemann, L Balicas… - Physical review …, 2007 - APS
We employ a combination of chemical substitution and angle resolved photoemission
spectroscopy to prove that the Fermi level in the γ band of Sr 2-y La y RuO 4 can be made to …
spectroscopy to prove that the Fermi level in the γ band of Sr 2-y La y RuO 4 can be made to …
Effect of crystal-field splitting and interband hybridization on the metal-insulator transitions of strongly correlated systems
We investigate a quarter-filled two-band Hubbard model involving a crystal-field splitting,
which lifts the orbital degeneracy as well as an interorbital hop** (interband hybridization) …
which lifts the orbital degeneracy as well as an interorbital hop** (interband hybridization) …
Low-energy effective Hamiltonians for correlated electron systems beyond density functional theory
M Hirayama, T Miyake, M Imada, S Biermann - Physical Review B, 2017 - APS
We propose a refined scheme of deriving an effective low-energy Hamiltonian for materials
with strong electronic Coulomb correlations beyond density functional theory (DFT). By …
with strong electronic Coulomb correlations beyond density functional theory (DFT). By …