We investigate the time evolution of a generic and finite isolated quantum many-body system starting from a pure quantum state. We find the kinematical general canonical principle proposed by Popescu-Short-Winter for statistical mechanics can be built in a more solid ground by studying the thermalization, i.e. comparing the density matrices themselves rather than the measures of distances. In particular, this allows us to explicitly identify that, from any instantaneous pure state after thermalization, the state of subsystem is like from a microcanonical ensemble or a generalized Gibbs ensemble, but neither a canonical nor a thermal ones due to finite-size effect. Our results are expected to bring the task of characterizing the state after thermalization to completion. In addition, thermalization of coupled systems with different temperatures corresponding to mixed initial states is studied.
We investigate the time evolution of a generic and finite isolated quantum many-body system starting from a pure quantum state. We find the kinematical general canonical principle proposed by Popescu-Short-Winter for statistical mechanics can be built in a more solid ground by studying the thermalization, i.e. comparing the density matrices themselves rather than the measures of distances. In particular, this allows us to explicitly identify that, from any instantaneous pure state after thermalization, the state of subsystem is like from a microcanonical ensemble or a generalized Gibbs ensemble, but neither a canonical nor a thermal ones due to finite-size effect. Our results are expected to bring the task of characterizing the state after thermalization to completion. In addition, thermalization of coupled systems with different temperatures corresponding to mixed initial states is studied.
A thermal equilibrium state of a quantum many-body system can be represented by a typical pure state, which we call a thermal pure quantum (TPQ) state. We construct the canonical TPQ state, which corresponds to the canonical ensemble of the conventional statistical mechanics. It is related to the microcanonical TPQ state, which corresponds to the microcanonical ensemble, by simple analytic transformations. Both TPQ states give identical thermodynamic results, if both ensembles do, in the thermodynamic limit. The TPQ states corresponding to other ensembles can also be constructed. We have thus established the TPQ formulation of statistical mechanics, according to which all quantities of statistical-mechanical interest are obtained from a single realization of any TPQ state. We also show that it has great advantages in practical applications. As an illustration, we study the spin-1/2 kagome Heisenberg antiferromagnet.
The role of the system-bath coupling is studied for the generalized canonical thermalization of a system S surrounded by a heat bath B, which was most recently shown [S. Popescu, et al., Nature Physics 2,754(2006) and S. Goldstein et al., Phys. Rev. Lett. 96, 050403(2006)] as a kinematic reduction to a canonical equilibrium state from almost all the pure states of the universe formed by S plus B. This kinematic process is revisited by explicitly considering the energy shell deformation due to the interaction between S and B with an exactly solvable model. By calculating the state numbers of the universe and its subsystems S and B in the deformed energy shells, it is found that, for the overwhelming majority of the universe states (they are entangled at least), the diagonal canonical typicality remains robust with respect to finite interactions between S and B. Particularly, the kinematic decoherence is utilized here to account for the vanishing of the off-diagonal elements of the reduced density matrix of S. It is pointed out that the non-vanishing off-diagonal elements due to the finiteness of bath and the stronger system-bath interaction might offer novelties of the quantum thermalization.
The emergence of statistical mechanics from quantum dynamics is conventionally understood through quantum chaos, the Eigenstate Thermalization Hypothesis (ETH), and canonical typicality, which together explain the thermal behavior of local observables in quantum many-body systems. We provide a distinct mechanism in which, for a quantum many-body system under strong random perturbation, the chaotic behavior of the system's eigenvectors and a constraint on the total energy directly generate a canonical ensemble for the entire system. The canonical ensemble occurs as the first moment of the Porter-Thomas distribution of the system's chaotic eigenstates, and the constraint on the total energy sets the temperature in the ensemble. This yields canonically distributed expectation values without invoking ETH, a microcanonical ensemble, or a subsystem-bath partition for local and global observables. We numerically demonstrate the mechanism for the 1D transverse-field Ising model by showing canonically distributed eigenstate projectors and spin-spin correlators with distinctive temperature dependence of the correlation length. An implementation of this thermalization approach on a quantum computer can be utilized for thermal state preparation.
We generalize the thermal pure quantum (TPQ) formulation of statistical mechanics, in such a way that it is applicable to systems whose Hilbert space is infinite dimensional. Assuming particle systems, we construct the grand-canonical TPQ (gTPQ) state, which is the counterpart of the grand-canonical Gibbs state of the ensemble formulation. A single realization of the gTPQ state gives all quantities of statistical-mechanical interest, with exponentially small probability of error. This formulation not only sheds new light on quantum statistical mechanics but also is useful for practical computations. As an illustration, we apply it to the Hubbard model, on a one-dimensional (1D) chain and on a two-dimensional (2D) triangular lattice. For the 1D chain, our results agree well with the exact solutions over wide ranges of temperature, chemical potential, and the on-site interaction. For the 2D triangular lattice, for which exact results are unknown, we obtain reliable results over a wide range of temperature. We also find that finite-size effects are much smaller in the gTPQ state than in the canonical TPQ state. This also shows that in the ensemble formulation the grand-canonical Gibbs state of a finite-size system simulates an infinite system much better than the canonical Gibbs state.
One key issue of the foundation of statistical mechanics is the emergence of equilibrium ensembles in isolated and closed quantum systems. Recently, it was predicted that in the thermodynamic (N→∞) limit of large quantum many-body systems, canonical density matrices emerge for small subsystems from almost all pure states. This notion of canonical typicality is assumed to originate from the entanglement between subsystem and environment and the resulting intrinsic quantum complexity of the many-body state. For individual eigenstates, it has been shown that local observables show thermal properties provided the eigenstate thermalization hypothesis holds, which requires the system to be quantum-chaotic. In the present paper, we study the emergence of thermal states in the regime of a quantum analog of a mixed phase space. Specifically, we study the emergence of the canonical density matrix of an impurity upon reduction from isolated energy eigenstates of a large but finite quantum system the impurity is embedded in. Our system can be tuned by means of a single parameter from quantum integrability to quantum chaos and corresponds in between to a system with mixed quantum phase space. We show that the probability for finding a canonical density matrix when reducing the ensemble of energy eigenstates of the finite many-body system can be quantitatively controlled and tuned by the degree of quantum chaos present. For the transition from quantum integrability to quantum chaos, we find a continuous and universal (i.e., size-independent) relation between the fraction of canonical eigenstates and the degree of chaoticity as measured by the Brody parameter or the Shannon entropy.
Understanding how isolated quantum systems thermalize has recently gathered renewed interest almost 100 years after the first work by von Neumann, thanks to the experimental realizations of such systems. Experimental and numerical pieces of evidence imply that nonintegrability of the system plays an important role in thermalization. Nonintegrable systems that conserve energy alone are expected to be effectively described by the (micro)canonical ensemble due to the so-called eigenstate thermalization hypothesis (ETH) in the thermodynamic limit. In contrast, it is expected that stationary states in integrable systems are described not by the canonical ensemble but by the generalized Gibbs ensemble (GGE) due to the existence of many nontrivial conserved quantities. In this thesis, we study thermalization and its mechanism in nonintegrable systems from two perspectives. We first study how well the ETH and its finite-size corrections can be predicted by random matrix theory (RMT). Next, we present our study on the emergence of the GGE in a nonintegrable system with an extensive number of local symmetries.