Real-time dynamics of Hubbard-type model systems via a combination of the Kadanoff-Baym formalism with adiabatic TDDFT
ORAL
Abstract
We propose a description of nonequilibrium systems via a simple protocol that combines DFT-exchange-correlation potentials with self-energies of many-body perturbation theory. The approach, aimed to avoid double counting of interactions, is tested against exact results in Hubbard-type systems, with respect to interaction strength, perturbation speed/inhomogeneity, and system dimensionality/size. In many regimes, we observe good agreement with the exact results, and an improvement over the pure adiabatic local TDDFT or the pure Second-Born NEGF approximations. We also address the reasons behind the residual discrepancies, and briefly discuss possible directions for future work.
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Authors
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Hopjan Miroslav
Lund University
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Daniel Karlsson
University of Jyv\"askyl\"a
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SImon Ydman
Lund University
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Claudio Verdozzi
Lund University
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Carl-Olof Almbladh
Lund University