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Register a new userOptimized hierarchical equations of motion for Drude dissipation
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The hierarchical equations of motion theory for Drude dissipation is optimized, with a convenient convergence criterion proposed in advance of numerical propagations. The theoretical construction is on basis of a Pad{e} spectrum decomposition that has been qualified to be the best sum-over-poles scheme for quantum distribution function. The resulting hierarchical dynamics under the {em apriori} convergence criterion are exemplified with a benchmark spin-boson system, and also the transient absorption and two-dimensional spectroscopy of a model exciton dimer system.
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We propose a nonperturbative quantum dissipation theory, in term of hierarchical quantum master equation. It may be used with a great degree of confidence to various dynamics systems in condensed phases. The theoretical development is rooted in an improved semiclassical treatment of Drude bath, beyond the conventional high temperature approximations. It leads to the new theory a simple modification but important improvement over the conventional stochastic Liouville equation theory, without extra numerical cost. Its broad range of validity and applicability is extensively demonstrated with two--level electron transfer model systems, where the new theory can be considered as the modified Zusman equation. We also present a criterion, which depends only on the system--bath coupling strength, characteristic bath memory time, and temperature, to estimate the performance of the hierarchical quantum master equation.
A nonperturbative theory is developed, aiming at an exact and efficient evaluation of a general quantum system interacting with arbitrary bath environment at any temperature and in the presence of arbitrary time-dependent external fields. An exact hierarchical equations of motion formalism is constructed on the basis of calculus-on-path-integral algorithm, via the auxiliary influence generating functionals related to the interaction bath correlation functions in a parametrization expansion form. The corresponding continued-fraction Greens functions formalism for quantum dissipation is also presented. Proposed further is the principle of residue correction, not just for truncating the infinite hierarchy, but also for incorporating the small residue dissipation that may arise from the practical difference between the true and the parametrized bath correlation functions. The final residue-corrected hierarchical equations of motion can therefore be used practically for the evaluation of arbitrary dissipative quantum systems.
The constraint relation for efficiency and power is crucial to design optimal heat engines operating within finite time. We find a universal constraint between efficiency and output power for heat engines operating in the low-dissipation regime. Such constraint is validated with an example of Carnot-like engine. Its microscopic dynamics is governed by the master equation. Based on the master equation, we connect the microscopic coupling strengths to the generic parameters in the phenomenological model. We find the usual assumption of low-dissipation is achieved when the coupling to thermal environments is stronger than the driving speed. Additionally, such connection allows the design of practical cycle to optimize the engine performance.
Normally, quantum fluctuations enhance the escape from metastable states in the presence of dissipation. Here we show that dissipation can enhance the stability of a quantum metastable system, consisting of a particle moving in a strongly asymmetric double well potential, interacting with a thermal bath. We find that the escape time from the metastable state has a nonmonotonic behavior versus the system-bath coupling and the temperature, producing a stabilizing effect.
Continuing our work on the nature and existence of fluctuation-dissipation relations (FDR) in linear and nonlinear open quantum systems [1-3], here we consider such relations when a linear system is in a nonequilibrium steady state (NESS). With the model of two-oscillators (considered as a short harmonic chain with the two ends) each connected to a thermal bath of different temperatures we find that when the chain is fully relaxed due to interaction with the baths, the relation that connects the noise kernel and the imaginary part of the dissipation kernel of the chain in one bath does not assume the conventional form for the FDR in equilibrium cases. There exists an additional term we call the `bias current that depends on the difference of the baths initial temperatures and the inter-oscillator coupling strength. We further show that this term is related to the steady heat flow between the two baths when the system is in NESS. The ability to know the real-time development of the inter-heat exchange (between the baths and the end-oscillators) and the intra-heat transfer (within the chain) and their dependence on the parameters in the system offers possibilities for quantifiable control and in the design of quantum heat engines or thermal devices.
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