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Koopmans spectral functionals are a class of orbital-density-dependent functionals designed to accurately predict spectroscopic properties. They do so markedly better than their Kohn-Sham density-functional theory counterparts, as…

Chemical Physics · Physics 2023-04-21 Yannick Schubert , Nicola Marzari , Edward Linscott

The entanglement properties of two-electron atomic systems have been the subject of considerable research activity in recent years. These studies are still somewhat fragmentary, focusing on numerical computations on particular states of…

Quantum Physics · Physics 2015-06-11 A. P. Majtey , A. R. Plastino , J. S. Dehesa

We examine the entanglement in the ground states of helium and helium-like ions using an original Hylleraas expansion. The von Neumann and linear entropies of the reduced density matrix are accurately computed by performing the Schmidt…

Quantum Physics · Physics 2020-01-08 Przemyslaw Koscik , Anna Okopinska

Electronic quantum entanglement between the central chain and the two electrodes in an infinite one-dimensional two-probe device system is studied. The entanglement entropy is calculated employing the nonequilibrium Green's function method…

Mesoscale and Nanoscale Physics · Physics 2016-03-02 Yao-Sheng Li , Wen-Long You , Xue-Feng Wang

Spin-entanglement of two electrons occupying two spatial regions -- domains -- is expressed in a compact form in terms of spin-spin correlation functions. The power of the formalism is demonstrated on several examples ranging from…

Mesoscale and Nanoscale Physics · Physics 2009-04-10 A. Ramsak , J. Mravlje , T. Rejec

The complicated ways in which electrons interact in many-body systems such as molecules and materials have long been viewed through the lens of local electron correlation and associated correlation functions. However, quantum information…

Strongly Correlated Electrons · Physics 2024-10-15 Tong Shen , Hatem Barghathi , Adrian Del Maestro , Brenda Rubenstein

In this work, we study the quantum entanglement for doubly excited resonance states in helium by using highly correlated Hylleraas type functions to represent such states of the two-electron system. The doubly-excited resonance states are…

Quantum Physics · Physics 2015-07-21 Chien-Hao Lin , Yew Kam Ho

We investigate the entanglement properties of an ensemble of atoms interacting with a single bosonic field mode via the Dicke (superradiance) Hamiltonian. The model exhibits a quantum phase transition and a well-understood thermodynamic…

Quantum Physics · Physics 2009-11-10 N. Lambert , C. Emary , T. Brandes

The relationship between the mean-field approximations in various interacting models of statistical physics and measures of classical and quantum correlations is explored. We present a method that allows us to bound the total amount of…

Quantum Physics · Physics 2009-11-10 Vlatko Vedral

Entanglement, a key resource of emerging quantum technologies, describes correlations between particles that defy classical physics. It has been studied extensively on various platforms, but has remained elusive in electron microscopy.…

Ongoing experimental efforts to measure with unprecedented precision electron-capture probabilities challenges the current theoretical models. The short range of the weak interaction necessitates an accurate description of the atomic…

Atomic Physics · Physics 2024-04-02 A. Andoche , L. Mouawad , P. -A. Hervieux , X. Mougeot , J. Machado , J. P. Santos

We study the relation between quantum entanglement and electron correlation in quantum chemistry calculations. We prove that the Hartree-Fock (HF) wave function does not violate Bell's inequality, thus is not entangled while the…

Quantum Physics · Physics 2007-06-25 Hefeng Wang , Sabre Kais

We consider the entanglement between two spatial subregions in the Lieb-Liniger model of bosons in one spatial dimension interacting via a contact interaction. Using ground state path integral quantum Monte Carlo we numerically compute the…

Quantum Gases · Physics 2016-09-07 C. M. Herdman , P. -N. Roy , R. G. Melko , A. Del Maestro

Calculations for two electrons in an elliptic quantum dot, using symmetry breaking at the unrestricted Hartree-Fock level and subsequent restoration of the broken parity via projection techniques, show that the electrons can localize and…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Constantine Yannouleas , Uzi Landman

The dynamics of entanglement and uncertainty relation is explored by solving the time-dependent Schr\"{o}dinger equation for coupled harmonic oscillator system analytically when the angular frequencies and coupling constant are arbitrarily…

Quantum Physics · Physics 2018-03-30 DaeKil Park

We assess proposals for entangling two distant atoms by measurement of emitted photons, analyzing how their performance depends on the photon detection efficiency. We consider schemes based on measurement of one or two photons and compare…

Entanglement entropy of quantum fields in gravitational settings is a topic of growing importance. This entropy of entanglement is conventionally computed relative to Cauchy hypersurfaces where it is possible via a partial tracing to…

High Energy Physics - Theory · Physics 2021-05-07 Yangang Chen , Lucas Hackl , Ravi Kunjwal , Heidar Moradi , Yasaman K. Yazdi , Miguel Zilhão

We investigate various aspects of capacity of entanglement in certain setups whose entanglement entropy becomes extensive and obeys a volume law. In particular, considering geometric decomposition of the Hilbert space, we study this measure…

High Energy Physics - Theory · Physics 2024-09-20 M. Reza Mohammadi Mozaffar

We numerically simulate the low-energy properties of interacting electrons in a random potential using the Hartree-Fock based exact diagonalization method. In particular, we investigate how the transport properties are influenced by the…

Disordered Systems and Neural Networks · Physics 2009-11-07 Frank Epperlein , Svetlana Kilina , Michael Schreiber , Sergey Uldanov , Thomas Vojta

We investigate how well the one-dimensional Hubbard model describes the entanglement of particles trapped in a string of quantum wells. We calculate the average single-site entanglement for two particles interacting via a contact…

Strongly Correlated Electrons · Physics 2010-09-23 J. P. Coe , V. V. França , I. D'Amico
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