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Thermodynamics of the Coarse-Graining Master Equation

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 Added by Gernot Schaller
 Publication date 2020
  fields Physics
and research's language is English




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We study the coarse-graining approach to derive a generator for the evolution of an open quantum system over a finite time interval. The approach does not require a secular approximation but nevertheless generally leads to a Lindblad-Gorini-Kossakowski-Sudarshan generator. By combining the formalism with Full Counting Statistics, we can demonstrate a consistent thermodynamic framework, once the switching work required for the coupling and decoupling with the reservoir is included. Particularly, we can write the second law in standard form, with the only difference that heat currents must be defined with respect to the reservoir. We exemplify our findings with simple but pedagogical examples.



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We analyze Lindblad-Gorini-Kossakowski-Sudarshan-type generators for selected periodically driven open quantum systems. All these generators can be obtained by temporal coarse-graining procedures, and we compare different coarse-graining schemes. Similar as for undriven systems, we find that a dynamically adapted coarse-graining time, effectively yielding non-Markovian dynamics by interpolating through a series of different but invididually Markovian solutions, gives the best results among the different coarse-graining schemes, albeit at highest computational cost.
We consider the application of fluctuation relations to the dynamics of coarse-grained systems, as might arise in a hypothetical experiment in which a system is monitored with a low-resolution measuring apparatus. We analyze a stochastic, Markovian jump process with a specific structure that lends itself naturally to coarse-graining. A perturbative analysis yields a reduced stochastic jump process that approximates the coarse-grained dynamics of the original system. This leads to a non-trivial fluctuation relation that is approximately satisfied by the coarse-grained dynamics. We illustrate our results by computing the large deviations of a particular stochastic jump process. Our results highlight the possibility that observed deviations from fluctuation relations might be due to the presence of unobserved degrees of freedom.
Systems operating out of equilibrium exchange energy and matter with the environment, thus producing entropy in their surroundings. Since the entropy production depends on the current flowing throughout the system, its quantification is affected by the level of coarse-graining we adopt. In particular, it has been shown that the description of a system via a Fokker-Planck equation (FPE) lead to an underestimation of the entropy production with respect to the corresponding one in terms of microscopic transition rates. Moreover, such a correction can be derived exactly. Here we review this derivation, generalizing it when different prescriptions to derive the FPE from a Langevin equation are adopted. Then, some open problems about Gaussian transition rates and underdamped limit are discussed. In the second part of the manuscript we present a new approach to dealing with the discrepancy in entropy production due to the coarse graining by introducing enough microscopic variables to correctly estimate the entropy production within the FPE description. We show that any discrete state system can be described by making explicit the contribution of each microscopic current.
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Lumping a Markov process introduces a coarser level of description that is useful in many contexts and applications. The dynamics on the coarse grained states is often approximated by its Markovian component. In this letter we derive finite-time bounds on the error in this approximation. These results hold for non-reversible dynamics and for probabilistic mappings between microscopic and coarse grained states.
The lattice-Boltzmann method (LBM) and its variants have emerged as promising, computationally efficient and increasingly popular numerical methods for modelling complex fluid flow. However, it is acknowledged that the method can demonstrate numerical instabilities, e.g., in the vicinity of shocks. We propose a simple and novel technique to stabilise the lattice-Boltzmann method by monitoring the difference between microscopic and macroscopic entropy. Populations are returned to their equilibrium states if a threshold value is exceeded. We coin the name Ehrenfests steps for this procedure in homage to the vehicle that we use to introduce the procedure, namely, the Ehrenfests idea of coarse-graining. The one-dimensional shock tube for a compressible isothermal fluid is a standard benchmark test for hydrodynamic codes. We observe that, of all the LBMs considered in the numerical experiment with the one-dimensional shock tube, only the method which includes Ehrenfests steps is capable of suppressing spurious post-shock oscillations.
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