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arXiv:2107.07821 · Physical Review Research

Dynamic mean-field theory for dense spin systems at infinite temperature

Timo Gräßer, Philip Bleicker, Dag-Björn Hering, Mohsen Yarmohammadi, Götz Silvester Uhrig

Published Dec 10, 2021• 11 citations
arXivHTMLPDF

Abstract

A dynamic mean-field theory for spin ensembles (spinDMFT) at infinite temperatures on arbitrary lattices is established. The approach is introduced for an isotropic Heisenberg model with $S=\frac{1}{2}$ and external field. For large coordination numbers, it is shown that the effect of the environment of each spin is captured by a classical time-dependent random mean field which is normally distributed. Expectation values are calculated by averaging over these mean fields, i.e., by a path integral over the normal distributions. A self-consistency condition is derived by linking the moments defining the normal distributions to spin autocorrelations. In this framework, we explicitly show how the rotating-wave approximation becomes a valid description for increasing magnetic field. We also demonstrate that the approach can easily be extended. Exemplarily, we employ it to reach a quantitative understanding of a dense ensemble of spins with dipolar interaction which are distributed randomly on a plane including static Gaussian noise as well.

DOI
10.1103/physrevresearch.3.043168

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Journal of Physics C Solid State Physics•Mar 10, 1983•29 citations
A dynamic mean-field theory for spin ensembles (spinDMFT) at infinite temperatures on arbitrary lattices is established. The approach is introduced for an isotropic Heisenberg model with S=12S=\frac{1}{2}S=21​ and external field. For large coordination numbers, it is shown that the effect of the environment of each spin is captured by a classical time-dependent random mean field which is normally distributed. Expectation values are calculated by averaging over these mean fields, i.e., by a path integral over the normal distributions. A self-consistency condition is derived by linking the moments defining the normal distributions to spin autocorrelations. In this framework, we explicitly show how the rotating-wave approximation becomes a valid description for increasing magnetic field. We also demonstrate that the approach can easily be extended. Exemplarily, we employ it to reach a quantitative understanding of a dense ensemble of spins with dipolar interaction which are distributed randomly on a plane including static Gaussian noise as well.
In recent years, a method for computing spin dynamics at infinite temperature (spinDMFT) was developed. It utilizes the ideas of dynamical mean-field theory for fermions: single-site approximation and a self-consistency condition to approximate time-dependent spin correlations. In this work, we develop a crucial extension of the method to systems at finite temperature, able to compute imaginary-time correlations and thermodynamical quantities. We benchmark the method by comparison to results in finite-size systems, obtaining very good agreement with correlations in a random-coupling system, good agreement for a ferromagnetic system and large discrepancies in the case of an antiferromagnet. We note the appearance of ferromagnetic order in the method. We discuss possible extensions and potential applications of the approach.
The dynamics of disordered nuclear spin ensembles are the subject of nuclear magnetic resonance studies. Due to the through-space long-range dipolar interaction generically many spins are involved in the time evolution, so that exact brute force calculations are impossible. The recently established spin dynamic mean-field theory (spinDMFT) represents an efficient and unbiased alternative to overcome this challenge. The approach only requires the dipolar couplings as input and the only prerequisite for its applicability is that each spin interacts with a large number of other spins. In this article, we show that spinDMFT can be used to describe spectral spin diffusion in static samples and to simulate zero-quantum line shapes which eluded an efficient quantitative simulation so far to the best of our knowledge. We perform benchmarks for two test substances that establish an excellent match with published experimental data. As spinDMFT combines low computational effort with high accuracy, we strongly suggest to use it for large-scale simulations of spin diffusion, which are important in various areas of magnetic resonance.
Dipolar spin ensembles with random spin positions are attracting much attention because they help us to understand decoherence as it occurs in solid-state quantum bits in contact with spin baths. Also, these ensembles are systems which may show many-body localization, at least in the sense of very slow spin dynamics. We present measurements of the autocorrelations of spins on diamond surfaces at infinite temperature in a doubly rotating frame which eliminates local disorder. Strikingly, the timescales in the longitudinal and the transversal channel differ by more than one order of magnitude, which is a factor much greater than one would have expected from simulations of spins on lattices. A previously developed dynamic mean-field theory for spins (spinDMFT) fails to explain this phenomenon. Thus, we improve it by extending it to clusters (CspinDMFT). This theory does capture the striking mismatch up to two orders of magnitude for random ensembles. Without positional disorder, however, the mismatch is only moderate with a factor below 4. The pivotal role of positional disorder suggests that the strong mismatch is linked to precursors of many-body localization.
We formulate a bosonic dynamical mean-field theory (B-DMFT) which provides a comprehensive, thermodynamically consistent framework for the theoretical investigation of correlated lattice bosons. The B-DMFT is applicable for arbitrary values of the coupling parameters and temperature and becomes exact in the limit of high spatial dimensions ddd or coordination number ZZZ of the lattice. In contrast to its fermionic counterpart, the construction of the B-DMFT requires different scalings of the hopping amplitudes with ZZZ depending on whether the bosons are in their normal state or in the Bose-Einstein condensate (BEC). A detailed discussion of how this conceptual problem can be overcome by performing the scaling in the action rather than in the Hamiltonian itself is presented. The B-DMFT treats normal and condensed bosons on equal footing and thus includes the effects caused by their dynamic coupling. It reproduces all previously investigated limits in parameter space, such as the Beliaev-Popov and Hartree-Fock-Bogoliubov approximations, and generalizes the existing mean-field theories of interacting bosons. The self-consistency equations of the B-DMFT are those of a bosonic single-impurity coupled to two reservoirs corresponding to bosons in the condensate and in the normal state, respectively. We employ the B-DMFT to solve a model of itinerant and localized, interacting bosons analytically. The local correlations are found to enhance the condensate density and the BEC transition temperature TBEC{T}_{\text{BEC}}TBEC​. This effect may be used experimentally to increase TBEC{T}_{\text{BEC}}TBEC​ of bosonic atoms in optical lattices.
Langevin equations for the relaxation of spin fluctuations in a soft-spin version of the Edwards-Anderson model are used as a starting point for the study of the dynamic and static properties of spin-glasses. An exact uniform Lagrangian for the average dynamic correlation and response functions is derived for arbitrary range of random exchange, using a functional-integral method proposed by De Dominicis. The properties of the Lagrangian are studied in the mean-field limit which is realized by considering an infinite-ranged random exchange. In this limit, the dynamics are represented by a stochastic equation of motion of a single spin with self-consistent (bare) propagator and Gaussian noise. The low-frequency and the static properties of this equation are studied both above and below Tc{T}_{c}Tc​. Approaching Tc{T}_{c}Tc​ from above, spin fluctuations slow down with a relaxation time proportional to ${|T\ensuremath{-}{T}_{c}|}^{\ensuremath{-}1}$ whereas at Tc{T}_{c}Tc​ the damping function vanishes as ${\ensuremath{\omega}}^{\frac{1}{2}}$. We derive a criterion for dynamic stability below Tc{T}_{c}Tc​. It is shown that a stable solution necessarily violates the fluctuation-dissipation theorem below Tc{T}_{c}Tc​. Consequently, the spin-glass order parameters are the time-persistent terms which appear in both the spin correlations and the local response. This is shown to invalidate the treatment of the spin-glass order parameters as purely static quantities. Instead, one has to specify the manner in which they relax in a finite system, along time scales which diverge in the thermodynamic limit. We show that the finite-time correlations decay algebraically with time as ${t}^{\ensuremath{-}\ensuremath{\nu}}$ at all temperatures below Tc{T}_{c}Tc​, with a temperature-dependent exponent $\ensuremath{\nu}$. Near Tc{T}_{c}Tc​, $\ensuremath{\nu}$ is given (in the Ising case) as $\ensuremath{\nu}(T)\ensuremath{\sim}\frac{1}{2}\ensuremath{-}{\ensuremath{\pi}}^{\ensuremath{-}1}(\frac{1\ensuremath{-}T}{{T}_{c}})+\ensuremath{\sigma}{(\frac{1\ensuremath{-}T}{{T}_{c}})}^{2}$. A tentative calculation of $\ensuremath{\nu}$ at T=0T=0T=0 K is presented. We briefly discuss the physical origin of the violation of the fluctuation-dissipation theorem.
The dynamical properties of a simple model of a spin glass are studied. The model has Gaussian random exchange interactions and Langevin dynamics. Following the ideas of Ma and Rudnick (1978) and of De Dominicis (1978), the spin glass phase is characterised by the presence of a finite limit of the spin autocorrelation function as t to infinity , i.e. by a delta-function part of it Fourier transform C( omega ). With a finite system in mind, this delta function is taken to have a small finite width. Then the fluctuation-dissipation theorem is imposed (before the infinite volume limit), forcing a corresponding low-frequency anomaly on the dynamical susceptibility. Solving self-consistently in mean-field theory for the order parameter, one then finds that the Almeida-Thouless instability of conventional theories is suppressed for all times shorter than the inverse width of the delta function in C( omega ). This theory is constructed for exactly zero external field; problems about the field dependence and possible relevance to experiment are discussed.