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A dynamical generalisation of the nonlocal coherent-potential approximation is derived based upon the functional integral approach to the interacting electron problem. The free energy is proven to be variational with respect to the…

Strongly Correlated Electrons · Physics 2014-11-25 D. A. Rowlands , Yu-Zhong Zhang

We present the derivation of an ab-initio and parameter free effective electron-electron interaction that goes beyond the screened RPA and accounts for superconducting pairing driven by spin-fluctuations. The construction is based on many…

Superconductivity · Physics 2015-06-23 F. Essenberger , A. Sanna , A. Linscheid , F. Tandetzky , G. Profeta , P. Cudazzo , E. K. U. Gross

Understanding non-equilibrium spin transport through 2D ferromagnets is a theoretical challenge, as correlations produce a complex electronic structure with coexisting itinerant and localized electrons. We have developed a fully…

Strongly Correlated Electrons · Physics 2025-10-29 Declan Nell , Stefano Sanvito , Andrea Droghetti

The correlated motion of electrons in the presence of strong orbital fluctuations and correlations is investigated with respect to magnetic couplings and excitations in an orbitally degenerate ferromagnet. Introduction of the orbital degree…

Strongly Correlated Electrons · Physics 2015-05-14 Dheeraj Kumar Singh , Bhaskar Kamble , Avinash Singh

In a quantum Hall ferromagnet, the spin polarization of the two-dimensional electron system can be dynamically transferred to nuclear spins in its vicinity through the hyperfine interaction. The resulting nuclear field typically acts back…

We calculate from first principles the electronic structure, relaxation and magnetic moments in small Fe particles, applying the numerical local orbitals method in combination with norm-conserving pseudopotentials. The accuracy of the…

Materials Science · Physics 2009-11-07 A. V. Postnikov , P. Entel , Jose M. Soler

We apply the self-interaction corrected local spin density %(SIC-LSD) approximation to study the electronic structure and magnetic properties of the spinel ferrites MnFe$_{2}$O$_{4}$, Fe$_{3}$O$_{4}$, CoFe$_{2}$O$_{4}$, and…

Materials Science · Physics 2009-11-11 Z. Szotek , W. M. Temmerman , D. Koedderitzsch , A. Svane , L. Petit , H. Winter

Anomalous magnetic and electronic properties of the half-metallic ferromagnets (HMF) have been discussed. The general conception of the HMF electronic structure which take into account the most important correlation effects from…

Strongly Correlated Electrons · Physics 2011-07-25 V. Yu. Irkhin , M. I. Katsnelson , A. I. Lichtenstein

We present the results of numerical studies for selected materials with strongly correlated electrons using a combination of the local-density approximation and dynamical mean-field theory (DMFT). For the solution of the DMFT equations a…

Strongly Correlated Electrons · Physics 2011-02-11 Arno P. Kampf , Marcus Kollar , Jan Kunes , Michael Sentef , Dieter Vollhardt

We have obtained the equilibrium volumes, bulk moduli, equations of state of the ferromagnetic cubic $\alpha$ and paramagnetic hexagonal $\epsilon$ phases of iron in close agreement with experiment using an ab initio dynamical mean-field…

Strongly Correlated Electrons · Physics 2014-10-20 L. V. Pourovskii , J. Mravlje , M. Ferrero , O. Parcollet , I. A. Abrikosov

We present a calculation of the dephasing time of electrons in a ferromagnet relevant for the conductance fluctuations. We focus on the contribution from the interaction with spin waves. Explicit results are presented for a…

Mesoscale and Nanoscale Physics · Physics 2013-05-29 Jeroen Danon , Piet W. Brouwer

Despite intense experimental effort, theoretical proposals and modeling approaches, a lack of consensus exists about the intrinsic mechanisms driving ultrafast magnetization dynamics in 3$d$ ferromagnets. In this work, we find evidence of…

Materials Science · Physics 2023-03-29 Theodor Griepe , Unai Atxitia

We introduce a computational scheme for calculating the electronic structure of random alloys that includes electronic correlations within the framework of the combined density functional and dynamical mean-field theory. By making use of…

Strongly Correlated Electrons · Physics 2018-12-26 A. Östlin , L. Vitos , L. Chioncel

The two-photon momentum distribution of annihilating electron-positron pairs in ferromagnetic nickel (Ni) was determined by measuring the spin-polarized two-dimensional angular correlation of annihilation radiation (ACAR). The spectra were…

We formulate a low-energy theory for the magnetic interactions between electrons in the multi-band Hubbard model under non-equilibrium conditions determined by an external time-dependent electric field which simulates laser-induced spin…

Strongly Correlated Electrons · Physics 2013-04-11 Andrea Secchi , Sergei Brener , Alexander I. Lichtenstein , Mikhail I. Katsnelson

We present a theory of magnetotransport through a system of two coupled electronic orbitals, where the electron spin interacts with a (large) local magnetic moment via an exchange interaction. For the physical realization of such a set-up…

Mesoscale and Nanoscale Physics · Physics 2012-11-06 Klemens Mosshammer , Gerold Kiesslich , Tobias Brandes

We compute the spin susceptibility of the two-dimensional Hubbard model away from half-filling, and analyze the impact of frequency dependent vertex corrections as obtained from the dynamical mean field theory (DMFT). We find that the local…

Strongly Correlated Electrons · Physics 2018-06-13 Demetrio Vilardi , Ciro Taranto , Walter Metzner

We present a formalism for strongly correlated electrons systems which consists in a local approximation of the dynamical three-leg interaction vertex. This vertex is self-consistently computed with a quantum impurity model with dynamical…

Strongly Correlated Electrons · Physics 2016-04-01 Thomas Ayral , Olivier Parcollet

A proper theoretical description of electronic structure of the 3d orbitals in the metal centers of functional metalorganics is a challenging problem. In this letter, we apply density functional theory and an exact diagonalization method in…

Time-dependent density functional theory is implemented in an all electron solid-state code for the case of fully non-collinear spins. We use this to study laser induced demagnetization in Fe, Co and Ni. It is shown that this…

Materials Science · Physics 2014-06-26 K. Krieger , J. K. Dewhurst , P. Elliott , S. Sharma , E. K. U. Gross