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Electronic Raman scattering and optical phonon self-energies are studied on single crystals of $LuB_{12}$ with different isotopic composition in the temperature region 10-650K and at pressures up to 10 GPa. The shape and energy position of…

Materials Science · Physics 2016-08-09 Yu. S. Ponosov , A. A. Makhnev , S. V. Streltsov , V. B. Filipov , N. Yu. Shitsevalova

We investigate the interaction of strongly correlated electrons with phonons in the frame of the Hubbard-Holstein model. The electron-phonon interaction is considered to be strong and is an important parameter of the model besides the…

Strongly Correlated Electrons · Physics 2009-11-07 V. A. Moskalenko , P. Entel , M. Marinaro , D. F. Digor

We present the first unbiased results for the mobility $\mu$ of one-dimensional Holstein polaron obtained by numerical analytic continuation combined with diagrammatic and world-line Monte Carlo methods in the thermodynamic limit. We have…

Strongly Correlated Electrons · Physics 2016-06-20 A. S. Mishchenko , N. Nagaosa , G. De Filippis , A. de Candia , V. Cataudella

A microcanonical treatment of Hagedorn systems, i.e. finite mass hadronic resonances with an exponential mass spectrum controlled by the Hagedorn temperature $T_H$, is performed. We show that, in the absence of any restrictions, a Hagedorn…

High Energy Physics - Phenomenology · Physics 2007-05-23 K. A. Bugaev , J. B. Elliott , L. G. Moretto , L. Phair

We propose a density matrix renormalization group (DMRG) technique at finite temperatures. As is the case of the ground state DMRG, we use a single-target state that is calculated by making use of a regulated polynomial expansion. Both…

Strongly Correlated Electrons · Physics 2009-03-09 Shigetoshi Sota , Takami Tohyama

This work addresses the one-dimensional problem of Bloch electrons when they are rapidly driven by a homogeneous time-periodic light and linearly coupled to vibrational modes. Starting from a generic time-periodic electron-phonon…

Mesoscale and Nanoscale Physics · Physics 2017-01-20 C. Dutreix , M. I. Katsnelson

We develop techniques to study the temperature dependent localization, thermalization, and the effects of phonon scattering on the excitons in halide perovskites from the analysis of the emission spectra. The excitonic Urbach edge, when…

Materials Science · Physics 2022-11-23 Kingshuk Mukhuti , Arnab Mandal , Basabendra Roy , Sayan Bhattacharyya , Bhavtosh Bansal

Based on the canonical Lang-Firsov transformation of the Hamiltonian we develop a very efficient quantum Monte Carlo algorithm for the Holstein model with one electron. Separation of the fermionic degrees of freedom by a reweighting of the…

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

The thermal and electrical transport properties of single-crystalline LaBe$_{13}$ have been investigated by specific-heat ($C$) and electrical-resistivity ($\rho$) measurements. The specific-heat measurements in a wide temperature range…

We introduce a new type of Gutzwiller variational wavefunction for correlated electrons coupled to phonons, able to treat on equal footing electronic and lattice degrees of freedom. We benchmark the wavefunction in the infinite-$U$…

Strongly Correlated Electrons · Physics 2007-07-24 P. Barone , R. Raimondi , M. Capone , C. Castellani , M. Fabrizio

We employ quasiparticle path integral molecular dynamics to study how the excitonic properties of model semiconductors are altered by electron-phonon coupling. We describe ways within a path integral representation of the system to evaluate…

Materials Science · Physics 2022-09-28 Yoonjae Park , David T. Limmer

We present in full detail a newly developed formalism enabling density functional perturbation theory (DFPT) calculations from a DFT+$U$ ground state. The implementation includes ultrasoft pseudopotentials and is valid for both insulating…

Strongly Correlated Electrons · Physics 2020-02-21 Andrea Floris , Iurii Timrov , Burak Himmetoglu , Nicola Marzari , Stefano de Gironcoli , Matteo Cococcioni

We investigate the non-monotonic temperature sensitivity of a coherently driven two-level quantum system coupled to an Ohmic phonon environment. By employing a unitary polaron transformation, we account for phonon-induced renormalization…

Quantum Physics · Physics 2026-04-17 Yildiz Berk Ates

We present an algorithm that extends existing quantum algorithms for simulating fermion systems in quantum chemistry and condensed matter physics to include bosons in general and phonons in particular. We introduce a qubit representation…

Quantum Physics · Physics 2020-10-30 Alexandru Macridin , Panagiotis Spentzouris , James Amundson , Roni Harnik

Conventional approaches for modulating thermal conductivity usually rely on structural modifications and therefore cannot achieve reversible in situ regulation. Targeted phonon excitation has recently emerged as a promising strategy for…

Materials Science · Physics 2026-05-13 Tianhao Li , Yangjun Qin , Dongkai Pan , Shixian Liu , Han Meng , Nuo Yang

Accurate electronic bandstructures of solids are indispensable for a wide variety of applications and should provide a sound prediction of phonon-induced band gap renormalization at finite temperatures. We employ our previously introduced…

Computational Physics · Physics 2024-03-22 Tammo van der Heide , Ben Hourahine , Bálint Aradi , Thomas Frauenheim , Thomas A. Niehaus

We use the dynamical mean-field method to calculate the charge density wave transition temperature of the half-filled Holstein model as function of typical phonon frequency in the physically relevant adiabatic limit of phonon frequency…

Strongly Correlated Electrons · Physics 2009-10-31 S. Blawid , A. J. Millis

A recently developed quantum Monte Carlo approach to the Holstein model with one electron [PRB 69, 024301 (2004)] is extended to two and three dimensional lattices. A moderate sign problem occurs, which is found to diminish with increasing…

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

While the thermoelectric figure of merit zT above 300K has seen significant improvement recently, the progress at lower temperatures has been slow, mainly limited by the relatively low Seebeck coefficient and high thermal conductivity. Here…

Materials Science · Physics 2016-02-17 Jiawei Zhou , Bolin Liao , Bo Qiu , Samuel Huberman , Keivan Esfarjani , Mildred S. Dresselhaus , Gang Chen

Using the Feynman-Pines diagram technique, the energy spectrum of localized quasi-particles interacting with polarization phonons is calculated and analyzed in the wide range of energies at the finite temperature of the system. It is…

Strongly Correlated Electrons · Physics 2017-02-13 M. V. Tkach , Ju. O. Seti , O. M. Voitsekhivska , O. Yu. Pytiuk