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We present an accurate and efficient formulation for the calculation of phonons in real-space Kohn-Sham density functional theory. Specifically, employing a local exchange-correlation functional, norm-conserving pseudopotential in the…

Chemical Physics · Physics 2023-03-30 Abhiraj Sharma , Phanish Suryanarayana

We performed a finite-temperature quantum Monte Carlo simulation of the one-dimensional spin-1/2 Heisenberg model with nearest-neighbor interaction coupled to Einstein phonons. Our method allows to treat easily up to 100 phonons per site…

Condensed Matter · Physics 2007-05-23 Rainer W. Kühne , Ute Löw

The polaron formation is investigated in the intermediate regime of the Holstein model by using an exact diagonalization technique for the one-dimensional infinite lattice. The numerical results for the electron and phonon propagators are…

Strongly Correlated Electrons · Physics 2007-05-23 O. S. Barisic

The formation of a polaron quasiparticle from a bare electron is studied in the framework of the Holstein model of electron-phonon coupling. Using Schr\"{o}dinger's formalism, we calculate the time evolution of the distribution of the…

Strongly Correlated Electrons · Physics 2007-05-23 Li-Chung Ku , S. A. Trugman

We investigate the scattering of an electron by phonons in a small structure between two one-dimensional tight-binding leads. This model mimics the quantum electron transport through atomic wires or molecular junctions coupled to metallic…

Strongly Correlated Electrons · Physics 2017-02-27 C. Brockt , E. Jeckelmann

We present a general harmonic theory for the temperature dependence of phonon-renormalized properties of solids. Firstly, we formulate a perturbation theory in phonon-phonon interactions to calculate the phonon renormalization of physical…

Materials Science · Physics 2015-10-28 Bartomeu Monserrat , G. J. Conduit , R. J. Needs

The possibility of using nanoelectromechanical systems as a simulation tool for quantum many-body effects is explored. It is demonstrated that an array of electrostatically coupled nanoresonators can effectively simulate the Bose-Hubbard…

We show that information on the probability density of local fluctuations can be obtained from a numerical renormalisation group calculation of a reduced density matrix. We apply this approach to the Anderson-Holstein impurity model to…

Strongly Correlated Electrons · Physics 2010-05-18 Alex C. Hewson , Johannes Bauer

Employing a largely unbiased variational exact diagonalization technique, we analyze the consequences of longer-ranged electron hopping and electron-phonon interaction on polaron formation in one dimension. Having at our disposal the…

Strongly Correlated Electrons · Physics 2024-02-20 Monodeep Chakraborty , Jayita Chatterjee , Holger Fehske

We use determinant quantum Monte Carlo to study the single particle properties of quasiparticles and phonons in a variant of the two-dimensional Holstein model that includes an additional non-linear electron-phonon (e-ph) interaction. We…

Superconductivity · Physics 2015-08-12 Shaozhi Li , E. A. Nowadnick , S. Johnston

In this work we investigate temperature dependence of electronic structure of system with strong electronic correlations and strong electron-phonon interaction modeling cuprates in the frameworks of the three-band p-d-Holstein model by a…

Strongly Correlated Electrons · Physics 2016-11-18 Ilya A. Makarov , Sergey G. Ovchinnikov

The electronic structure of condensed matter can be significantly affected by the electron-phonon interaction, leading to important phenomena such as electrical resistance, superconductivity or the formation of polarons. This interaction is…

We have studied the interplay of a local phonon mode embedded in a metallic host (Holstein impurity model) using Abelian bosonization. The phonon frequency softens, which takes place in two steps: first, their frequency starts softening,…

Strongly Correlated Electrons · Physics 2009-11-11 Balázs Dóra

This paper describes experiments utilizing a unique property of electron-glasses to gain information on the fundamental nature of the interacting Anderson-localized phase. The methodology is based on measuring the energy absorbed by the…

Strongly Correlated Electrons · Physics 2015-01-16 Z. Ovadyahu

We present a flexible density-matrix renormalization group approach to calculate finite-temperature spectral functions of one-dimensional strongly correlated quantum systems. The method combines the purification of the finite-temperature…

Strongly Correlated Electrons · Physics 2014-09-02 Alexander C. Tiegel , Salvatore R. Manmana , Thomas Pruschke , Andreas Honecker

We consider the Thermofield Dynamics bosonization to perform a field theory analysis of the effective Lagrangian model for incommensurate charge density waves (ICDW) in one-dimensional systems at finite temperature. The phonon degree of…

Statistical Mechanics · Physics 2012-04-19 Luiz Victorio Belvedere , Rubens Gurgel Amaral , Armando Flavio Rodrigues

The one-dimensional Holstein-Hubbard model with two electrons of opposite spin is studied using an extension of a recently developed quantum Monte Carlo method, and a very simple yet rewarding variational approach, both based on a…

Strongly Correlated Electrons · Physics 2007-05-23 Martin Hohenadler , Wolfgang von der Linden

Ab initio calculations of the phonon-induced band structure renormalization are currently based on the perturbative Allen-Heine theory and its many-body generalizations. These approaches are unsuitable to describe materials where electrons…

The effects of quantum lattice fluctuations on the Peierls transition are studied within the one--dimensional Holstein molecular crystal model by means of exact diagonalization methods. Applying a very efficient variational Lanczos…

Strongly Correlated Electrons · Physics 2007-05-23 A. Weiße , H. Fehske

An optimized sideband cooling in the presence of initial system correlations is investigated for a standard optomechanical system coupled to a general mechanical non-Markovian reservoir. We study the evolution of phonon number by…

Quantum Physics · Physics 2023-11-27 Wen-Zhao Zhang , Ting Tan , Jie Zhao , Wenlin Li , Jiong Cheng
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