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We use the exact strong-interaction limit of the Hohenberg-Kohn energy density functional to construct an approximation for the exchange-correlation term of the Kohn-Sham approach. The resulting exchange-correlation potential is able to…

Strongly Correlated Electrons · Physics 2013-04-05 Francesc Malet , André Mirtschink , Jonas C. Cremon , Stephanie M. Reimann , Paola Gori-Giorgi

The properties of hydrogen under extreme conditions are important for many applications, including inertial confinement fusion and astrophysical models. A key quantity is given by the electronic density response to an external perturbation,…

Computational Physics · Physics 2022-08-17 Maximilian Böhme , Zhandos Moldabekov , Jan Vorberger , Tobias Dornheim

It is demonstrated that the charge Tomonaga-Luttinger parameter $K_\rho$ of quantum wires can be estimated accurately using the Hartree-Fock approximation if carried out self consistently. The dependence of $K_\rho$ on the carrier density…

Mesoscale and Nanoscale Physics · Physics 2015-06-24 Wolfgang Häusler , A. H. MacDonald

We study the low-temperature low-frequency conductivity sigma of an interacting one dimensional electron system in the presence of a periodic potential. The conductivity is strongly influenced by conservation laws, which, we argue, need be…

Strongly Correlated Electrons · Physics 2009-10-31 A. Rosch , N. Andrei

The functional-renormalization-group aided density-functional theory (FRG-DFT) is applied to the two-dimensional homogeneous electron gas (2DHEG). The correlation energy of the 2DHEG is derived as a function of the Wigner-Seitz radius $…

Strongly Correlated Electrons · Physics 2019-03-13 Takeru Yokota , Tomoya Naito

We introduce a new form of density functional theory for the {\em ab initio} description of electronic systems in contact with a molecular liquid environment. This theory rigorously joins an electron density-functional for the electrons of…

Soft Condensed Matter · Physics 2009-11-11 Sahak Petrosyan , Jean-Francois Briere , David Roundy , T. A. Arias

We present an accurate local density-functional for electronic-structure calculations within the density functional theory (DFT). The functional is derived by analyzing the structure of the standard perturbative expansion of the correlation…

Materials Science · Physics 2024-11-28 Mario Benites , Angel Rosado , Efstratios Manousakis

We develop a theoretical model for the description of electron dynamics in coupled quantum wires when the local magnetic moment is formed in one of the wires. We employ a single-particle Hamiltonian that takes account of the specific…

Strongly Correlated Electrons · Physics 2009-11-10 V. I. Puller , L. G. Mourokh , A. Shailos , J. P. Bird

We construct the complementary short-range correlation relativistic local-density-approximation functional to be used in relativistic range-separated density-functional theory based on a Dirac-Coulomb Hamiltonian in the no-pair…

Chemical Physics · Physics 2021-05-26 Julien Paquier , Julien Toulouse

We calculate the density of states for an interacting quantum wire in the presence two impurities of arbitrary potential strength. To perform this calculation, we describe the Coulomb interactions in the wire within the Tomonaga-Luttinger…

Mesoscale and Nanoscale Physics · Physics 2014-08-12 R. Zamoum , M. Guigou , C. Bena , A. Crépieux

Understanding the electrical conductivity of warm dense hydrogen is critical for both fundamental physics and applications in planetary science and inertial confinement fusion. We demonstrate how to calculate the electrical conductivity…

Materials Science · Physics 2025-02-14 Kushal Ramakrishna , Mani Lokamani , Attila Cangi

We study the ground state properties of rectangular quantum dots by using the spin-density-functional theory and quantum Monte Carlo methods. The dot geometry is determined by an infinite hard-wall potential to enable comparison to…

Strongly Correlated Electrons · Physics 2009-11-10 E. Räsänen , H. Saarikoski , V. N. Stavrou , A. Harju , M. J. Puska , R. M. Nieminen

We present a controlled method for computing the exchange coupling in correlated one-dimensional electron systems based on the relation between the exchange constant and the pair-correlation function of spinless electrons. This relation is…

Strongly Correlated Electrons · Physics 2007-05-23 Michael M. Fogler , Eugene Pivovarov

We reformulate the Tomonaga--Luttinger liquid theory for quasi-one-dimensional Fermion systems with many subbands across the Fermi energy. Our theory enables us to obtain a rigorous expression of the local density of states (LDOS) for…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 Hideo Yoshioka , Hiroyuki Shima

One of the most powerful strategies to address properties of real many-body systems is to incorporate data obtained for models, for example, to use data of the homogeneous electron gas in order to build the Local Density Approximation for…

Materials Science · Physics 2026-05-05 Muhammed Hüseyin Güneş , Ayoub Aouina , Vitaly Gorelov , Matteo Gatti , Lucia Reining

A system of soft ellipsoid molecules confined between two planar walls is studied using classical Density Functional Theory (DFT). Both the isotropic and nematic phases are considered. The excess free energy is evaluated using two different…

Materials Science · Physics 2009-11-10 David Cheung , Friederike Schmid

In this work we study the thermodynamic properties of ultrathin ferromagnetic dots using Monte Carlo simulations. We investigate the vortex density as a function of the temperature and the vortex structure in monolayer dots with…

Computational Physics · Physics 2015-06-26 M. Rapini , R. A. Dias , D. P. Landau , B. V. Costa

The capability of density-functional theory to deal with the ground-state of strongly correlated low-dimensional systems, such as semiconductor quantum dots, depends on the accuracy of functionals developed for the exchange and correlation…

Strongly Correlated Electrons · Physics 2009-02-25 S. Pittalis , E. Rasanen , C. Proetto , E. K. U. Gross

In this article, we report a fully ab initio variational Monte Carlo study of the linear, and periodic chain of Hydrogen atoms, a prototype system providing the simplest example of strong electronic correlation in low dimensions. In…

Strongly Correlated Electrons · Physics 2015-05-30 Lorenzo Stella , Claudio Attaccalite , Sandro Sorella , Angel Rubio

Understanding the properties of warm dense hydrogen is of key importance for the modeling of compact astrophysical objects and to understand and further optimize inertial confinement fusion (ICF) applications. The work horse of warm dense…