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The Wave Function Matching (WFM) technique has recently been developed for the calculation of electronic transport in quantum two-probe systems. In terms of efficiency it is comparable with the widely used Green's function approach. The WFM…

Two single-particle sources coupled in series to a chiral electronic waveguide can serve as a probabilistic source of two-particle excitations with tunable properties. The second-order correlation function, characterizing the state of…

Mesoscale and Nanoscale Physics · Physics 2014-01-07 Michael Moskalets

We calculate the quasiparticle effective mass for the electron gas in two and three dimensions in the metallic region. We employ the single particle scattering potential coming from the Sj\"{o}lander-Stott theory and enforce the Friedel sum…

Condensed Matter · Physics 2009-10-28 Andrey Krakovsky , J. K. Percus

When two-dimensional electrons are subjected to a very strong magnetic field, they are believed to form a triangular Wigner crystal. We demonstrate that, in the entire crystal phase, this crystal is very well represented by a…

Mesoscale and Nanoscale Physics · Physics 2018-09-25 Chia-Chen Chang , Gun Sang Jeon , Jainendra K. Jain

A simple method of variational calculations of the electronic structure of a two-electron atom/ion, primarily near the nucleus, is proposed. The method as a whole consists of a standard solution of a generalized matrix eigenvalue equation,…

Atomic Physics · Physics 2024-10-08 Evgeny Z. Liverts

We investigate the accuracy of trial wave function for quantum Monte Carlo based on pfaffian functional form with singlet and triplet pairing. Using a set of first row atoms and molecules we find that these wave functions provide very…

Other Condensed Matter · Physics 2009-02-20 M. Bajdich , L. Mitas , G. Drobný , L. K. Wagner , K. E. Schmidt

We present a Gaussian-basis implementation of orbital-free density-functional theory (OF-DFT) in which the trust-region image method (TRIM) is used for optimization. This second-order optimization scheme has been constructed to provide…

Chemical Physics · Physics 2021-09-15 Matthew S. Ryley , Michael Withnall , Tom J. P. Irons , Trygve Helgaker , Andrew M. Teale

We consider necessary conditions for the one-body-reduced density matrix (1RDM) to correspond to a triplet wave-function of a two electron system. The conditions concern the occupation numbers and are different for the high spin…

Chemical Physics · Physics 2016-05-30 Iris Theophilou , Nektarios N. Lathiotakis , Nicole Helbig

A study of fermion nodes for spin-polarized states of a few-electron ions and molecules with $s,p,d$ one-particle orbitals is presented. We find exact nodes for some cases of two electron atomic and molecular states and also the first exact…

Other Condensed Matter · Physics 2009-11-10 Michal Bajdich , Lubos Mitas , Gabriel Drobný , Lucas K. Wagner

The effective Hamiltonian of strongly correlated electrons on a square lattice is replaced by a renormalised Hamiltonian and the factors that renormalise the kinetic energy of holes and the Heisenberg spin-spin coupling are calculated using…

Strongly Correlated Electrons · Physics 2007-05-23 F. C. Zhang , C. Gros , T. M. Rice , H. Shiba

The variational determination of the two-fermion reduced density matrix is described for harmonically trapped, ultracold few-fermion systems in one dimension with equal spin populations. This is accomplished by formulating the problem as a…

Quantum Gases · Physics 2022-11-11 Mitchell J. Knight , Harry M. Quiney , Andy M. Martin

We study the ground--state shell correction energy of a fermionic gas in a mean--field approximation. Considering the particular case of 3D harmonic trapping potentials, we show the rich variety of different behaviors (erratic, regular,…

Nuclear Theory · Physics 2008-11-26 Jérôme Roccia , Patricio Leboeuf

Random bond Hamiltonians of the $\pi$ flux state on the square lattice are investigated. It has a special symmetry and all states are paired except the ones with zero energy. Because of this, there are always zero-modes. The states near…

Condensed Matter · Physics 2009-10-28 Yasuhiro Hatsugai , Xiao-Gang Wen , Mahito Kohmoto

In principle, many-electron correlation energy can be precisely computed from a reduced Wigner distribution function ($\mathcal{W}$) thanks to a universal functional transformation ($\mathcal{F}$), whose formal existence is akin to that of…

Chemical Physics · Physics 2019-01-23 Rutvij Vihang Bhavsar , Raghunathan Ramakrishnan

Wavefunction forms based on products of electron pairs are usually constructed as closed-shell singlets, which is insufficient when the molecular state has a nonzero spin or when the chemistry is determined by $d$- or $f-$electrons. A set…

We introduce the transcorrelated Density Matrix Renormalization Group (tcDMRG) theory for the efficient approximation of the energy for strongly correlated systems. tcDMRG encodes the wave function as a product of a fixed Jastrow or…

Strongly Correlated Electrons · Physics 2020-11-13 Alberto Baiardi , Markus Reiher

Electron fractionalization is intimately related to topology. In one-dimensional systems, fractionally charged states exist at domain walls between degenerate vacua. In two-dimensional systems, fractionalization exists in quantum Hall…

Mesoscale and Nanoscale Physics · Physics 2008-11-26 Chang-Yu Hou , Claudio Chamon , Christopher Mudry

We analyze the role of resonances in two-fermion entanglement production for a quasi one-dimensional two channel scattering problem. We solve exactly for the problem of a two-fermion antisymmetric product state scattering off a double delta…

Quantum Physics · Physics 2016-08-16 Alexander López , Otto Rendón , Víctor M. Villalba , Ernesto Medina

We show that the exact wave function for two electrons, interacting through a Coulomb potential but constrained to remain on the surface of a $\mathcal{D}$-sphere ($\mathcal{D} \ge 1$), is a polynomial in the interelectronic distance $u$…

Other Condensed Matter · Physics 2010-02-19 Pierre-François Loos , Peter M. W. Gill

We study the electronic band-structure and transport properties of a CuO2-plane within the three-band Hubbard model. The Dynamical Mean-Field Theory (DMFT) is used to solve the many particle problem. The calculations show that the optical…

Strongly Correlated Electrons · Physics 2007-05-23 M. B. Zoelfl , Th. Maier , Th. Pruschke , J. Keller
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