We study the statistics and short-time dynamics of the classical and the quantum Fermi-Pasta-Ulam chain in the thermal equilibrium. We analyze the distributions of single-particle configurations by integrating out the rest of the system. At low temperatures, we observe a systematic increase in the mobility of the chain when transitioning from classical to quantum mechanics due to zero-point energy effects. We analyze the consequences of quantum dispersion on the dynamics at short times of configurational correlation functions.
We study the statistics and short-time dynamics of the classical and the quantum Fermi-Pasta-Ulam chain in the thermal equilibrium. We analyze the distributions of single-particle configurations by integrating out the rest of the system. At low temperatures, we observe a systematic increase in the mobility of the chain when transitioning from classical to quantum mechanics due to zero-point energy effects. We analyze the consequences of quantum dispersion on the dynamics at short times of configurational correlation functions.
We investigate the mechanism of heat conduction in one-dimensional (1D) quantum FPU chain with quantum fluctuation in the framework of semiquantal molecular dynamics. In the semiquantal many-body simulations, a Hartree-type many-body wave function is adopted for a whole chain and a single-particle state of a particle is represented by a trial wave function with Jackiw–Kerman (JK) form. With the help of the Dirac's time-dependent variational principle (TDVP), a set of equations of the variational parameters contained in the JK wave packet is obtained, and it describes the quantum dynamics of the nonlinear lattices approximately. These equations not only prove highly efficient in recovering dynamics of classical heat conduction, but also allow exploring the case with quantum mechanical characteristics. As a consequence, we find the thermal conductivity diverges with system size as well as in the classical version when considering quantum fluctuation. Furthermore, in three different temperature regions it is observed that the enhancement of the quantum fluctuation increases the heat flux through the 1D quantum FPU chain.
Energy equipartition can be established in short-range systems after the dynamic process of thermalization. However, energy distribution between different degrees of freedom in systems with long-range interactions is unclear. We study the dynamics of energy relaxation in the Fermi-Pasta-Ulam-Tsingou β model with long-range quartic interactions, which decay as 1/d^{δ} with d being the lattice distance. The dynamic crossover of a mode-energy distribution from localized to equipartitioned with the increase of the power δ is observed. A transition of mode-energy distribution is identified around the value of δ=1, which usually serves as the distinction between strong and weak long-range couplings. We elucidate that the varying frequency overlapping of the mode-energy power spectrum is responsible for this dynamic crossover. Through further calculation of the spectral entropy, the minimum duration of quasistationary states, τ_{QSS}, is found at δ=2, which may provide possible dynamic explanations for the peculiar behavior of heat transport in long-range lattice chains. In addition, the double scaling in τ_{QSS} as a function of energy density is also observed in our long-range lattices. Our results not only contribute to understanding the dynamics of energy relaxation in long-range systems, but also shed light on the longstanding problem of thermalization and low-dimensional heat transport in short-range systems.
In their seminal work, Fermi, Pasta, Ulam and Tsingou explored the connection between statistical mechanics and dynamical properties, such as chaos and ergodicity. Even today, seventy years later, the topic is not fully understood: while most results of statistical mechanics require the ergodic hypothesis to be rigorously proved, there are many indications that these predictions, both in and out of equilibrium, hold even in the absence of a rigorous form of ergodicity. Motivated by the above considerations, in this work we reconsider the point of view that the relevant ingredients for the validity of statistical mechanics are the large number of degrees of freedom and the choice of extensive observables, while the details of the dynamics do not play an essential role. This is the idea behind Khinchin's famous proof of the typicality of macroscopic observables at equilibrium. We extend this perspective to the context of non equilibrium, by investigating the thermalization properties of both harmonic (integrable) and nonharmonic (chaotic) oscillator chains initially prepared in out-of-equilibrium conditions. In integrable systems, thermalization occurs, or not, depending on the observable. In the chaotic regime, instead, thermalization is reached by any observable, although the relaxation timescale might be larger than the observation time.
We study the transition from integrability to chaos for the three-particle Fermi–Pasta–Ulam–Tsingou (FPUT) model. We can show that both the quartic β-FPUT model (α=0) and the cubic one (β=0) are integrable by introducing an appropriate Fourier representation to express the nonlinear terms of the Hamiltonian. For generic values of α and β, the model is non-integrable and displays a mixed phase space with both chaotic and regular trajectories. In the classical case, chaos is diagnosed by the investigation of Poincaré sections. In the quantum case, the level spacing statistics in the energy basis belongs to the Gaussian orthogonal ensemble in the chaotic regime, and crosses over to Poissonian behavior in the quasi-integrable low-energy limit. In the chaotic part of the spectrum, two generic observables obey the eigenstate thermalization hypothesis.
We investigate the relation between thermalization following a quantum quench and many-body localization in quasi-particle space in terms of the long-time full distribution function of physical observables. In particular, expanding on our recent work (Canovi et al 2011 Phys. Rev. B 83 094431), we focus on the long-time behavior of an integrable XXZ chain subject to an integrability-breaking perturbation. After a characterization of the breaking of integrability and the associated localization/delocalization transition using the level spacing statistics and the properties of the eigenstates, we study the effect of integrability breaking on the asymptotic state after a quantum quench of the anisotropy parameter, looking at the behavior of the full probability distribution of the transverse and longitudinal magnetization of a subsystem. We compare the resulting distributions with those obtained in equilibrium at an effective temperature set by the initial energy. We find that, while the long-time distribution functions appear to always agree qualitatively with the equilibrium ones, quantitative agreement is obtained only when integrability is fully broken and the relevant eigenstates are diffusive in quasi-particle space.
The relaxation of Fourier modes of Hamiltonian chains close to equilibrium is studied in the framework of a simple mode-coupling theory. Explicit estimates of the dependence of relevant time scales on the energy density (or temperature) and on the wave number of the initial excitation are given. They are in agreement with previous numerical findings on the approach to equilibrium and turn out to be also useful in the qualitative interpretation of them. The theory is compared with molecular dynamics results in the case of the quartic Fermi-Pasta-Ulam potential.