No Arabic abstract
Lower temperature leads to a higher probability of visiting low-energy states. This intuitive belief underlies most physics-inspired strategies for addressing hard optimization problems. For instance, the popular simulated annealing (SA) dynamics is expected to approach a ground state if the temperature is lowered appropriately. Here we demonstrate that this belief is not always justified. Specifically, we employ the cavity method to analyze the minimum strong defensive alliance problem and discover a bifurcation in the solution space, induced by an inflection point in the entropy--energy profile. While easily accessible configurations are associated with the lower-free-energy branch, the low-energy configurations are associated with the higher-free-energy branch within the same temperature range. There is a discontinuous phase transition between the high-energy configurations and the ground states, which generally cannot be followed by SA. We introduce an energy-clamping strategy to obtain superior solutions by following the higher-free-energy branch, overcoming the limitations of SA.
By means of the principle of minimal sensitivity we generalize the microcanonical inflection-point analysis method by probing derivatives of the microcanonical entropy for signals of transitions in complex systems. A strategy of systematically identifying and locating independent and dependent phase transitions of any order is proposed. The power of the generalized method is demonstrated in applications to the ferromagnetic Ising model and a coarse-grained model for polymer adsorption onto a substrate. The results shed new light on the intrinsic phase structure of systems with cooperative behavior.
We construct a complete set of Wannier functions which are localized at both given positions and momenta. This allows us to introduce the quantum phase space, onto which a quantum pure state can be mapped unitarily. Using its probability distribution in quantum phase space, we define an entropy for a quantum pure state. We prove an inequality regarding the long time behavior of our entropys fluctuation. For a typical initial state, this inequality indicates that our entropy can relax dynamically to a maximized value and stay there most of time with small fluctuations. This result echoes the quantum H-theorem proved by von Neumann in [Zeitschrift fur Physik {bf 57}, 30 (1929)]. Our entropy is different from the standard von Neumann entropy, which is always zero for quantum pure states. According to our definition, a system always has bigger entropy than its subsystem even when the system is described by a pure state. As the construction of the Wannier basis can be implemented numerically, the dynamical evolution of our entropy is illustrated with an example.
Many thermodynamic relations involve inequalities, with equality if a process does not involve dissipation. In this article we provide equalities in which the dissipative contribution is shown to involve the relative entropy (a.k.a. Kullback-Leibler divergence). The processes considered are general time evolutions both in classical and quantum mechanics, and the initial state is sometimes thermal, sometimes partially so. By calculating a transport coefficient we show that indeed---at least in this case---the source of dissipation in that coefficient is the relative entropy.
Entropy production during the process of thermal phase-separation of multiphase flows is investigated by means of a discrete Boltzmann kinetic model. The entropy production rate is found to increase during the spinodal decomposition stage and to decrease during the domain growth stage, attaining its maximum at the crossover between the two. Such behaviour provides a natural criterion to identify and discriminate between the two regimes. Furthermore, the effects of heat conductivity, viscosity and surface tension on the entropy production rate are investigated by systematically probing the interplay between non-equilibrium energy and momentum fluxes. It is found that the entropy production rate due to energy fluxes is an increasing function of the Prandtl number, while the momentum fluxes exhibit an opposite trend. On the other hand, both contributions show an increasing trend with surface tension. The present analysis inscribes within the general framework of non-equilibrium thermodynamics and consequently it is expected to be relevant to a broad class of soft-flowing systems far from mechanical and thermal equilibrium.
We present a numerical analysis of the entropy rate and statistical complexity related to the spin flip dynamics of the 2D Ising Ferromagnet at different temperatures T. We follow an information theoretic approach and test three different entropy estimation algorithms to asses entropy rate and statistical complexity of binary sequences. The latter are obtained by monitoring the orientation of a single spin on a square lattice of side-length L=256 at a given temperature parameter over time. The different entropy estimation procedures are based on the M-block Shannon entropy (a well established method that yields results for benchmarking purposes), non-sequential recursive pair substitution (providing an elaborate and an approximate estimator) and a convenient data compression algorithm contained in the zlib-library (providing an approximate estimator only). We propose an approximate measure of statistical complexity that emphasizes on correlations within the sequence and which is easy to implement, even by means of black-box data compression algorithms. Regarding the 2D Ising Ferromagnet simulated using Metropolis dynamics and for binary sequences of finite length, the proposed approximate complexity measure is peaked close to the critical temperature. For the approximate estimators, a finite-size scaling analysis reveals that the peak approaches the critical temperature as the sequence length increases. Results obtained using different spin-flip dynamics are briefly discussed. The suggested complexity measure can be extended to non-binary sequences in a straightforward manner.