Master equations of Lindblad type have attained prominent status in the fields of quantum optics and quantum information since they are guaranteed to satisfy fundamental notions of quantum dynamics such as complete positivity. When Lindblad operators are used to describe thermal reservoirs in contact with an open quantum system, the fundamental laws of thermodynamics and the fluctuation‐dissipation theorem provide additional mandatory criteria. We show several examples of innocent‐looking Lindblad operators which have questionable properties in this regard. Compatibility criteria between Hamiltonian and Lindblad terms as well as consequences of their violation are discussed. An alternative stochastic approach to dissipative quantum dynamics is outlined and illustrated through a harmonic‐chain model for which the approach of local Lindblad operators fails.
Master equations of Lindblad type have attained prominent status in the fields of quantum optics and quantum information since they are guaranteed to satisfy fundamental notions of quantum dynamics such as complete positivity. When Lindblad operators are used to describe thermal reservoirs in contact with an open quantum system, the fundamental laws of thermodynamics and the fluctuation‐dissipation theorem provide additional mandatory criteria. We show several examples of innocent‐looking Lindblad operators which have questionable properties in this regard. Compatibility criteria between Hamiltonian and Lindblad terms as well as consequences of their violation are discussed. An alternative stochastic approach to dissipative quantum dynamics is outlined and illustrated through a harmonic‐chain model for which the approach of local Lindblad operators fails.
We contribute to a long-standing debate on the supposed failure of the fluctuation dissipation theorem (FDT) for the Davies master equation (DME), an important class of Lindblad quantum master equations, describing time-driven quantum systems weakly coupled to a heat bath. First we propose two simple and natural criteria on the driving which guarantee compatibility with the FDT. We show through our setting that, contrary to what is often stated in the literature, the DME is fully compatible with the FDT. We thus argue that the cause of the dispute lies in the adopted perturbation scheme, rather than in the Lindblad character of the master equation itself. We confirm our statement by proving that the Grabert master equation, first proposed by Grabert [Projection Operator Techniques in Nonequilibrium Statistical Mechanics (Springer, Berlin, 1982)] as an alternative linear dynamics fulfilling the FDT, is nothing else than the incriminated DME. Our criteria for the FDT can also be used in the analysis of the nonlinear thermodynamical master equation, first obtained in the Brownian motion limit [H. Grabert, Z. Phys. B 49, 161 (1982)] and later independently rediscovered and generalized on purely thermodynamic grounds [H. C. \"Ottinger, Europhys. Lett. 94, 10006 (2011)].
Open quantum systems play a central role in contemporary nanoscale technologies, including molecular electronics, quantum heat engines, quantum computation and information processing. A major theoretical challenge is to construct dynamical models that are simultaneously consistent with classical thermodynamics and complete positivity. In this work, we develop a framework that addresses this issue by extending classical stochastic dynamics to the quantum domain. We begin by formulating a generalized Langevin equation in which both friction and noise act symmetrically on the two Hamiltonian equations. From this, we derive a generalized Klein-Kramers equation expressed in terms of Poisson brackets, and we show that it admits the Boltzmann distribution as its stationary solution while satisfying the first and second laws of thermodynamics along individual trajectories. Applying canonical quantization to this classical framework yields two distinct quantum master equations, depending on whether the friction operators are taken to be Hermitian or non-Hermitian. By analyzing the dynamics of a harmonic oscillator, we determine the conditions under which these equations reduce to a Lindblad-type generator. Our results demonstrate that complete positivity is ensured only when friction and noise are included in both Hamiltonian equations, thus fully justifying the classical construction. Moreover, we find that the friction coefficients must satisfy the same positivity condition in both the Hermitian and non-Hermitian formulations, revealing a form of universality that transcends the specific operator representation. The formalism offers a versatile tool for deriving quantum versions of the thermodynamic laws and is directly applicable to a wide class of nonequilibrium nanoscale systems.
It is very common in the literature to write a Markovian quantum master equation in Lindblad form to describe a system with multiple degrees of freedom and weakly connected to multiple thermal baths which can, in general, be at different temperatures and chemical potentials. However, the microscopically derived quantum master equation up to leading order in a system-bath coupling is of the so-called Redfield form, which is known to not preserve complete positivity in most cases. Additional approximations to the Redfield equation are required to obtain a Lindblad form. We lay down some fundamental requirements for any further approximations to the Redfield equation, which, if violated, leads to physical inconsistencies such as inaccuracies in the leading order populations and coherences in the energy eigenbasis, violation of thermalization, and violation of local conservation laws at the nonequilibrium steady state. We argue that one or more of these conditions will generically be violated in all the weak system-bath-coupling Lindblad descriptions existing in the literature to our knowledge. As an example, we study the recently derived universal Lindblad equation and use these conditions to show the violation of local conservation laws due to inaccurate coherences but accurate populations in the energy eigenbasis. Finally, we exemplify our analytical results numerically in an interacting open quantum spin system.
Abstract Open quantum systems play a central role in current nanoscale technologies, such as molecular electronics, quantum heat engines, quantum computation and information processing. A major theoretical challenge is to construct dynamical models that are simultaneously consistent with classical thermodynamics and with the requirement of complete positivity of quantum evolution. In this work we develop a framework that addresses this issue by systematically extending classical stochastic dynamics to the quantum domain. We begin by formulating a generalized Langevin equation in which both friction and noise act symmetrically on the two Hamiltonian equations. From this, we derive a generalized Klein–Kramers equation expressed in terms of Poisson brackets, and we show that it admits the Boltzmann distribution as its stationary solution while fulfilling the first and second laws of thermodynamics along individual trajectories. Applying canonical quantization to this classical framework yields two distinct quantum master equations, depending on whether the friction operators are taken to be Hermitian or non-Hermitian. By analyzing the dynamics of a harmonic oscillator, we determine the conditions under which these equations reduce to a Lindblad-type generator. Our results demonstrate that complete positivity is ensured only when friction and noise are included in both Hamiltonian equations, fully justifying the classical construction. Moreover, we find that the friction coefficients must adhere to the same positivity condition in both the Hermitian and non-Hermitian formulations, revealing a form of universality that transcends the specific operator representation. The formalism developed here presents a thermodynamically consistent and completely positive quantum extension of classical stochastic mechanics. It offers a versatile tool for deriving quantum versions of thermodynamic laws and is directly applicable to a broad class of non-equilibrium nanoscale systems of current theoretical and technological interest.
We derive a fundamental conservation law of operator current for master equations describing reduced quantum systems. If this law is broken, the temporal integral of the current operator of an arbitrary system observable does not yield in general the change of that observable in the evolution. We study Lindblad-type master equations as examples and prove that the application of the secular approximation during their derivation results in a violation of the conservation law. We show that generally any violation of the law leads to artificial corrections to the complete quantum dynamics, thus questioning the accuracy of the particular master equation.