When do weak-coupling approaches accurately capture the dynamics of complex quantum systems?

Understanding the dynamics of higher-dimensional quantum systems embedded in a complex environment remains a significant theoretical challenge. While several approaches yielding numerically converged solutions exist, these are computationally expensive and often provide only limited physical insight. Here we address the question when more intuitive and simpler to compute weak-coupling approaches still provide adequate accuracy. We develop a simple analytical criterion and verify its validity for the case of the much-studied FMO dynamics as well as the canonical spin-boson model.Comment: 10 pages, 5 figures, comments are very welcome

Environmental dynamics, correlations, and the emergence of noncanonical equilibrium states in open quantum systems

Quantum systems are invariably open, evolving under surrounding influences rather than in isolation. Standard open quantum system methods eliminate all information on the environmental state to yield a tractable description of the system dynamics. By incorporating a collective coordinate of the environment into the system Hamiltonian, we circumvent this limitation. Our theory provides straightforward access to important environmental properties that would otherwise be obscured, allowing us to quantify the evolving system-environment correlations. As a direct result, we show that the generation of robust system-environment correlations that persist into equilibrium (heralded also by the emergence of non-Gaussian environmental states) renders the canonical system steady-state almost always incorrect. The resulting equilibrium states deviate markedly from those predicted by standard perturbative techniques and are instead fully characterised by thermal states of the mapped system-collective coordinate Hamiltonian. We outline how noncanonical system states could be investigated experimentally to study deviations from canonical thermodynamics, with direct relevance to molecular and solid-state nanosystems.Comment: 10 pages, 4 figures, close to published versio

Nonequilibrium thermodynamics in the strong coupling and non-Markovian regime based on a reaction coordinate mapping

We propose a method to study the thermodynamic behaviour of small systems beyond the weak coupling and Markovian approximation, which is different in spirit from conventional approaches. The idea is to redefine the system and environment such that the effective, redefined system is again coupled weakly to Markovian residual baths and thus, allows to derive a consistent thermodynamic framework for this new system-environment partition. To achieve this goal we make use of the reaction coordinate mapping, which is a general method in the sense that it can be applied to an arbitrary (quantum or classical and even time-dependent) system coupled linearly to an arbitrary number of harmonic oscillator reservoirs. The core of the method relies on an appropriate identification of a part of the environment (the reaction coordinate), which is subsequently included as a part of the system. We demonstrate the power of this concept by showing that non-Markovian effects can significantly enhance the steady state efficiency of a three-level-maser heat engine, even in the regime of weak system-bath coupling. Furthermore, we show for a single electron transistor coupled to vibrations that our method allows one to justify master equations derived in a polaron transformed reference frame.Comment: updated and improved version; 19 pages incl. 10 figures and 5 pages appendi

Virtual excitations in the ultra-strongly-coupled spin-boson model: physical results from unphysical modes

Here we show how, in the ultra-strongly-coupled spin-boson model, apparently unphysical "Matsubara modes" are required not only to regulate detailed balance, but also to arrive at a correct and physical description of the non-perturbative dynamics and steady-state. In particular, in the zero-temperature limit, we show that neglecting the Matsubara modes results in an erroneous emission of virtual photons from the collective ground state. To explore this difficult-to-model regime we start by using a non-perturbative hierarchical equations of motion (HEOM) approach, based on a partial fitting of the bath correlation-function which takes into account the infinite sum of Matsubara frequencies using only a biexponential function. We compare the HEOM method to both a pseudo-mode model, and the reaction coordinate (RC) mapping, which help explain the nature of the aberrations observed when Matsubara frequencies are neglected. For the pseudo-mode method we present a general proof of validity, which allows for negative Matsubara-contributions to the decomposition of the bath correlation functions to be described by zero-frequency Matsubara-modes with non-Hermitian coupling to the system. The latter obey a non-Hermitian pseudo-Schr\"odinger equation, ultimately justifying why superficially unphysical modes can give rise to physical system behavior.Comment: 21 page

Amplified opto-mechanical transduction of virtual radiation pressure

Here we describe how, utilizing a time-dependent opto-mechanical interaction, a mechanical probe can provide an amplified measurement of the virtual photons dressing the quantum ground state of an ultra strongly-coupled light-matter system. We calculate the thermal noise tolerated by this measurement scheme, and discuss a range of experimental setups in which it could be realized.Comment: 7 + 12 pages, 1 figur