The Gibbs state is widely taken to be the equilibrium state of a system in contact with an environment at temperature T. However, non-negligible interactions between system and environment can give rise to an altered state. Here, we derive general expressions for this mean force Gibbs state, valid for any system that interacts with a bosonic reservoir. First, we derive the state in the weak coupling limit and find that, in general, it maintains coherences with respect to the bare system Hamiltonian. Second, we develop a new expansion method suited to investigate the ultrastrong coupling regime. This allows us to derive the explicit form for the mean force Gibbs state, and we find that it becomes diagonal in the basis set by the system-reservoir interaction instead of the system Hamiltonian. Several examples are discussed including a single qubit, a three-level V-system, and two coupled qubits all interacting with bosonic reservoirs. The results shed light on the presence of coherences in the strong coupling regime, and provide key tools for nanoscale thermodynamics investigations.
The Gibbs state is widely taken to be the equilibrium state of a system in contact with an environment at temperature T. However, non-negligible interactions between system and environment can give rise to an altered state. Here, we derive general expressions for this mean force Gibbs state, valid for any system that interacts with a bosonic reservoir. First, we derive the state in the weak coupling limit and find that, in general, it maintains coherences with respect to the bare system Hamiltonian. Second, we develop a new expansion method suited to investigate the ultrastrong coupling regime. This allows us to derive the explicit form for the mean force Gibbs state, and we find that it becomes diagonal in the basis set by the system-reservoir interaction instead of the system Hamiltonian. Several examples are discussed including a single qubit, a three-level V-system, and two coupled qubits all interacting with bosonic reservoirs. The results shed light on the presence of coherences in the strong coupling regime, and provide key tools for nanoscale thermodynamics investigations.
The Gibbs state is widely taken to be the equilibrium state of a system in contact with an environment at temperature T. However, non-negligible interactions between system and environment can give rise to an altered state. Here we derive general expressions for this mean force Gibbs state, valid for any system that interacts with a bosonic reservoir. First, we derive the state in the weak coupling limit and find that, in general, it maintains coherences with respect to the bare system Hamiltonian. Second, we develop a new expansion method suited to investigate the ultrastrong coupling regime. This allows us to derive the explicit form for the mean force Gibbs state, and we find that it becomes diagonal in the basis set by the system-reservoir interaction instead of the system Hamiltonian. Several examples are discussed including a single qubit, a three-level V-system and two coupled qubits all interacting with bosonic reservoirs. The results shed light on the presence of coherences in the strong coupling regime, and provide key tools for nanoscale thermodynamics investigations.
Two qubits strongly coupled to a common bosonic reservoir can become entangled with each other, despite having no direct interaction. In equilibrium, such coupling-induced coherences can be described by the mean-force Gibbs state. Here we derive approximate, analytic expressions for the two-qubit mean-force Gibbs state, and use these to characterize equilibrium qubit-qubit entanglement mediated by a thermal reservoir. Entanglement, which is highest at lowest temperatures, is a non-monotonic function of the system-reservoir coupling strength. Moreover, we find that broadening the reservoir spectral density beyond a single mode, as is realistic for typical baths, can enhance the qubit entanglement. Our results provide a comprehensive understanding of reservoir-mediated two-qubit entanglement in thermal equilibrium and provide a benchmark to compare with numerical methods, as well as demonstrating the utility of strong system-reservoir coupling as a resource.
The equilibrium state of a quantum system can deviate from the Gibbs state if the system-environment (SE) coupling is not weak. An analytical expression for this mean force Gibbs state (MFGS) is known in the ultrastrong coupling (USC) regime for the Caldeira-Leggett (CL) model that assumes a harmonic environment. Here, we derive analytical expressions for the MFGS in the USC regime for more general SE models. For all the generalized models considered here, we find the USC state to be diagonal in the basis set by the SE interaction, just like in the CL case. While for the generic model considered, the corresponding USC-MFGS is found to alter from the CL result, we do identify a class of models more general than the CL model for which the CL-USC result remains unchanged. We also provide numerical verification for our results. These results provide key tools for the study of strong coupling quantum thermodynamics and several quantum chemistry and biology problems under more realistic SE models, going beyond the CL model.
An open quantum system interacting with a heat bath at a given temperature is expected to reach the mean force Gibbs (MFG) state as a steady state. The MFG state is given by tracing out the bath degrees of freedom from the equilibrium Gibbs state of the total system plus bath. When the interaction between the system and the bath is not negligible, it is different from the usual system Gibbs state obtained from the system Hamiltonian only. Using the path integral method, we present the exact MFG state for a coupled system of quantum harmonic oscillators in contact with multiple thermal baths at the same temperature. We develop a nonperturbative method to calculate the covariances with respect to the MFG state. By comparing them with those obtained from the system Gibbs state, we find that the effect of coupling to the bath decays exponentially as a function of the distance from the system-bath boundary. This is similar to the skin effect found recently for a quantum spin chain interacting with an environment. Using the exact results, we also investigate the ultrastrong coupling limit where the coupling between the system and the bath gets arbitrarily large and makes a connection with the recent result found for a general quantum system.
The dynamical convergence of a system to the thermal distribution, or Gibbs state, is a standard assumption across all of the physical sciences. The Gibbs state is determined just by temperature and energies of the system. However, at decreasing system sizes, i.e., for nanoscale and quantum systems, the interaction with their environments is not negligible. The question then arises: Is the system's steady state still the Gibbs state? If not, how may the steady state depend on the interaction details? Here, we provide an overview of recent progress on answering these questions. We expand on the state of the art along two general avenues: First, we take the static point-of-view, which postulates the so-called mean force Gibbs state. This view is commonly adopted in the field of strong coupling thermodynamics, where modified laws of thermodynamics and nonequilibrium fluctuation relations are established on the basis of this modified state. Second, we take the dynamical point of view, originating from the field of open quantum systems, which examines the time-asymptotic steady state within two paradigms. We describe the mathematical paradigm, which proves return to equilibrium, i.e., convergence to the mean force Gibbs state, and then discuss a number of microscopic physical methods, particularly master equations. We conclude with a summary of established links between statics and equilibration dynamics and provide an extensive list of open problems. This comprehensive overview will be of interest to researchers in the wider fields of quantum thermodynamics, open quantum systems, mesoscopic physics, statistical physics, and quantum optics and will find applications whenever energy is exchanged on the nanoscale, from quantum chemistry and biology to magnetism and nanoscale heat management.
When the strength of interaction between a quantum system and bath is non-negligible, the equilibrium state can deviate from the Gibbs state. But the expression of such a mean force Gibbs state in an arbitrary parameter regime is unknown and is numerically challenging to determine. In this work, we first review the local harmonic approximation to this problem [Maier et al., Phys. Rev. E 81, 021107 (2010)], which can accurately determine the mean force Gibbs state when either the system-bath coupling or the temperature is large, or when the third and higher derivatives of the potential are small compared to certain system-bath specific parameters. In the appropriate limit, we show that the local harmonic approximation reduces to the ultra-strong coupling and high temperature results recently derived in the literature. After deriving an estimate for the error induced by this method, we apply it to study some systems, like a quartic oscillator and a particle in a quartic double-well potential. We also apply this method to analyze the proton tunneling problem in a DNA recently studied in literature [Slocombe et al., Comm. Phys., vol. 5, no. 1, p. 109, 2022], where our results suggest the equilibrium value of the probability of mutation to be orders of magnitude lower than the steady state value obtained there (10−8 vs 10−4).