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Ab initio calculations play an essential role in our fundamental understanding of quantum many-body systems across many subfields, from strongly correlated fermions to quantum chemistry and from atomic and molecular systems to nuclear…

We introduce a real-space version of the Bardeen-Cooper-Schrieffer interaction allowing the investigation of the non-trivial interplay between many-body physics and particles confinement on a quantum graph. When the two-body problem is…

Quantum Physics · Physics 2023-05-29 Francesco Romeo

Traditional multiconfiguration Hartree-Fock (MCHF) and configuration interaction (CI) methods are based on a single orthonormal orbital basis (OB). For atoms with complicated shell structures, a large OB is needed to saturate all the…

Atomic Physics · Physics 2015-06-12 S. Verdebout , P. Rynkun , P. Jönsson , G. Gaigalas , C. Froese Fischer , M. Godefroid

Many methods for computing electronic correlation effects at finite temperature are related to many-body perturbation theory in the grand-canonical ensemble. In most applications, however, the average number of electrons is known rather…

Materials Science · Physics 2022-10-21 Felix Hummel

The exchange splitting $J$ of the interaction energy of the hydrogen atom with a proton is calculated using the conventional surface-integral formula $J_{\textrm{surf}}[\varphi]$, the volume-integral formula of the symmetry-adapted…

Chemical Physics · Physics 2015-07-09 Piotr Gniewek , Bogumił Jeziorski

The Fourier component of the potential energy of interaction of an atom with an atom is represented as a polynomial of the fourth degree from the atomic form factor. A numerical calculation was performed for the atomic form factor in the…

Atomic Physics · Physics 2020-04-28 Vladimir. P. Koshcheev , Dmitry. A. Morgun , Yuriy. N. Shtanov

We calculate the one-, two- and three-particle energy levels for different lattice volumes in the complex $\varphi^4$ theory on the lattice. We argue that the exponentially suppressed finite-volume corrections for the two- and…

High Energy Physics - Lattice · Physics 2018-10-23 Fernando Romero-López , Akaki Rusetsky , Carsten Urbach

We develop a framework to systematically investigate the influence of many-particle interference on the dynamics of generic $-$ possibly interacting $-$ bosonic systems. We consider mixtures of bosons which belong to several distinguishable…

Quantum Physics · Physics 2020-10-07 Gabriel Dufour , Tobias Brünner , Alberto Rodríguez , Andreas Buchleitner

We develop a variational approach at finite temperature that incorporates many-body correlation self-consistently. The grand potential is constructed in terms of Green's function expressed by the variational parameters. We apply this…

Quantum Gases · Physics 2019-05-30 Akimitsu Kirikoshi , Wataru Kohno , Takafumi Kita

A method for constructing semianalytical strongly correlated wave functions for single and molecular quantum dots is presented. It employs a two-step approach of symmetry breaking at the Hartree-Fock level and of subsequent restoration of…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 Constantine Yannouleas , Uzi Landman

We present unrestricted Hartree Fock method coupled with configuration interaction (CI) method (URHF-CI) suitable for the calculation of ground and excited states of large number of electrons localized by complex gate potentials in…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 Ramin M. Abolfath , Pawel Hawrylak

Quantum Monte Carlo simulations of interacting electrons in solids often use Slater-Jastrow trial wave functions with Jastrow factors containing one- and two-body terms. In uniform systems the long-range behavior of the two-body term may be…

Materials Science · Physics 2007-05-23 R. Gaudoin , M. Nekovee , W. M. C. Foulkes , R. J. Needs , G. Rajagopal

The wave-structure of moving electrons is analyzed on a fundamental level by employing a modified de Broglie relation. Formalizing the wave-function $\psi$ in real notation yields internal energy components due to mass oscillations. The…

Quantum Physics · Physics 2008-02-03 W. A. Hofer

The self-consistent theory of the correlation effects in Highly Correlated Systems(HCS) is presented. The novel Irreducible Green's Functions(IGF) method is discused in detail for the Hubbard model and random Hubbard model. The…

Strongly Correlated Electrons · Physics 2008-02-03 A. L. Kuzemsky

Quantum many-body nuclear dynamics is treated at the mean-field level with the time-dependent Hartree-Fock (TDHF) theory. Low-lying and high-lying nuclear vibrations are studied using the linear response theory. The fusion mechanism is also…

Nuclear Theory · Physics 2014-02-05 C. Simenel , M. Dasgupta , D. J. Hinde , A. Kheifets , A. Wakhle

We formulate a general theory of wave-particle duality for many-body quantum states, which quantifies how wave- and particle-like properties balance each other. Much as in the well-understood single-particle case, which-way information --…

Quantum Physics · Physics 2021-09-01 Christoph Dittel , Gabriel Dufour , Gregor Weihs , Andreas Buchleitner

Helium atom is the simplest many-body electronic system provided by nature. The exact solution to the Schr\"odinger equation is known for helium ground and excited states, and represents a workbench for any many-body methodology. Here, we…

Atomic Physics · Physics 2017-04-26 Jing Li , Markus Holzmann , Ivan Duchemin , Xavier Blase , Valerio Olevano

Potential Energy Surface for the ($\mathrm{\bar{p}} - \mathrm{He}^{2+} - \mathrm{He}$) system is calculated in the framework of the restricted (singlet spin state) Hartree-Fock method with subsequent account of the electronic correlations…

Nuclear Theory · Physics 2017-06-29 S. N. Yudin , I. V. Bodrenko , G. Ya. Korenman

Accurate ab initio calculations of the energy levels of the superheavy elements Z=112 are presented. Relativistic Hartree-Fock and configuration interaction methods are combined with the many-body perturbation theory to construct the…

Atomic Physics · Physics 2010-09-20 T. H. Dinh , V. A. Dzuba , V. V. Flambaum

The compressibility of a two-dimensional electron system with spin in a spatially correlated random potential and a quantizing magnetic field is investigated. Electron-electron interaction is treated with the Hartree-Fock method. Numerical…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Alexander Struck , Bernhard Kramer
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