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The strong-interaction limit of the Hohenberg-Kohn functional defines a multimarginal optimal transport problem with Coulomb cost. From physical arguments, the solution of this limit is expected to yield strictly-correlated particle…

Strongly Correlated Electrons · Physics 2017-02-17 Michael Seidl , Simone Di Marino , Augusto Gerolin , Luca Nenna , Klaas J. H. Giesbertz , Paola Gori-Giorgi

We present here novel insight into exchange-correlation functionals in density functional theory, based on the viewpoint of optimal transport. We show that in the case of two electrons and in the semiclassical limit, the exact…

Analysis of PDEs · Mathematics 2015-03-19 Codina Cotar , Gero Friesecke , Claudia Klüppelberg

The many-body Coulomb repulsive energy of strictly correlated electrons provides direct information of the exact Hohenberg-Kohn exchange-correlation functional in the strong interaction limit. Until now the treatment of strictly correlated…

Chemical Physics · Physics 2013-03-13 Christian B. Mendl , Lin Lin

We prove rigorously that the exact N-electron Hohenberg-Kohn density functional converges in the strongly interacting limit to the strictly correlated electrons (SCE) functional, and that the absolute value squared of the associated…

Mathematical Physics · Physics 2018-04-04 Codina Cotar , Gero Friesecke , Claudia Klüppelberg

We theoretically study the single electron transfer through two-terminal quantum ring capacitively coupled to charged dot placed in its center. For this purpose we solve time-dependent Schrodinger equation for fully correlated two-particle…

Mesoscale and Nanoscale Physics · Physics 2015-05-18 T. Chwiej , K. Kutorasinski

We consider an analytically solvable model of two interacting electrons that allows for the calculation of the exact exchange-correlation kernel of time-dependent density functional theory. This kernel, as well as the corresponding density…

Strongly Correlated Electrons · Physics 2017-05-04 Luis Cort , Daniel Karlsson , Giovanna Lani , Robert van Leeuwen

The exchange-correlation energy in Kohn-Sham density functional theory can be expressed exactly in terms of the change in the expectation of the electron-electron repulsion operator when, in the many-electron hamiltonian, this same operator…

Strongly Correlated Electrons · Physics 2009-08-05 Paola Gori-Giorgi , Giovanni Vignale , Michael Seidl

We present a theory of magnetotransport through a system of two coupled electronic orbitals, where the electron spin interacts with a (large) local magnetic moment via an exchange interaction. For the physical realization of such a set-up…

Mesoscale and Nanoscale Physics · Physics 2012-11-06 Klemens Mosshammer , Gerold Kiesslich , Tobias Brandes

We study the transport properties of interacting electrons in a disordered quantum wire within the framework of the Luttinger liquid model. We demonstrate that the notion of weak localization is applicable to the strongly correlated…

Disordered Systems and Neural Networks · Physics 2007-05-23 I. V. Gornyi , A. D. Mirlin , D. G. Polyakov

An analogue of the quadratic Wasserstein (or Monge-Kantorovich) distance between Borel probability measures on $\mathbf{R}^d$ has been defined in [F. Golse, C. Mouhot, T. Paul: Commun. Math. Phys. 343 (2015), 165-205] for density operators…

Mathematical Physics · Physics 2021-02-10 Emanuele Caglioti , François Golse , Thierry Paul

An exact solution is derived for the wave function of an electron in a semiconductor quantum wire with spin-orbit interaction and driven by external time dependent harmonic confining potential. The formalism allows analytical expressions…

Quantum Physics · Physics 2015-06-11 T. Cadez , J. H. Jefferson , A. Ramsak

By propagating the many-body Schr\"odinger equation, we determine the exact time-dependent Kohn-Sham potential for a system of strongly correlated electrons which undergo field-induced tunneling. Numerous features are entirely absent from…

Strongly Correlated Electrons · Physics 2021-01-15 Matthew J. P. Hodgson , James D. Ramsden , Jacob B. J. Chapman , Piers Lillystone , Rex W Godby

We reformulate the strong-interaction limit of electronic density functional theory in terms of a classical problem with a degenerate minimum. This allows us to clarify many aspects of this limit, and to write a general solution, which is…

Materials Science · Physics 2007-05-23 Michael Seidl , Paola Gori-Giorgi , Andreas Savin

Quantum embedding theories are promising approaches to investigate strongly-correlated electronic states of active regions of large-scale molecular or condensed systems. Notable examples are spin defects in semiconductors and insulators. We…

Materials Science · Physics 2021-12-14 He Ma , Nan Sheng , Marco Govoni , Giulia Galli

We study the energetic properties of finite but internally homogeneous D-dimensional electron droplets in the strict-correlation limit. The indirect Coulomb interaction is found to increase as a function of the electron number, approaching…

Strongly Correlated Electrons · Physics 2011-05-11 E. Rasanen , M. Seidl , P. Gori-Giorgi

We derive the effective one-dimensional Schrodinger-Pauli equation for electrons constrained to move on a space curve. The electrons are confined using a double thin-wall quantization procedure with adiabatic separation of fast and slow…

Mesoscale and Nanoscale Physics · Physics 2018-09-27 Carmine Ortix

We use the exact strong-interaction limit of the Hohenberg-Kohn energy density functional to approximate the exchange-correlation energy of the restricted Kohn-Sham scheme. Our approximation corresponds to a highly non-local density…

Strongly Correlated Electrons · Physics 2012-12-12 Francesc Malet , Paola Gori-Giorgi

We use a generalized master equation (GME) to describe the nonequilibrium magnetotransport of interacting electrons through a broad finite quantum wire with an embedded ring structure. The finite quantum wire is weakly coupled to two broad…

Mesoscale and Nanoscale Physics · Physics 2012-03-15 Vidar Gudmundsson , Chi-Shung Tang , Olafur Jonasson , Valeriu Moldoveanu , Andrei Manolescu

We study the transport properties of two electrons in a quasi one-dimensional disordered wire. The electrons are subject to both, a disorder potential and a short range two-body interaction. Using the approach developed by Iida et al. […

Disordered Systems and Neural Networks · Physics 2009-11-07 Jean Richert , Hans A. Weidenmuller

The most challenging scenario for Kohn-Sham density functional theory, that is when the electrons move relatively slowly trying to avoid each other as much as possible because of their repulsion (strong-interaction limit), is reformulated…

Strongly Correlated Electrons · Physics 2015-06-05 Giuseppe Buttazzo , Luigi De Pascale , Paola Gori-Giorgi
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