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arXiv:1612.03848 · Physical review. E

Computation of the asymptotic states of modulated open quantum systems with a numerically exact realization of the quantum trajectory method

Valentin Volokitin, Alexey Liniov, Iosif B. Meyerov, M. Hartmann, Mikhail Ivanchenko, Peter Hänggi A, S. Denisov

Published Nov 29, 2017• 13 citations
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Abstract

Quantum systems out of equilibrium are presently a subject of active research, both in theoretical and experimental domains. In this work, we consider time-periodically modulated quantum systems that are in contact with a stationary environment. Within the framework of a quantum master equation, the asymptotic states of such systems are described by time-periodic density operators. Resolution of these operators constitutes a nontrivial computational task. Approaches based on spectral and iterative methods are restricted to systems with the dimension of the hosting Hilbert space dimH=N≲300, while the direct long-time numerical integration of the master equation becomes increasingly problematic for N≳400, especially when the coupling to the environment is weak. To go beyond this limit, we use the quantum trajectory method, which unravels the master equation for the density operator into a set of stochastic processes for wave functions. The asymptotic density matrix is calculated by performing a statistical sampling over the ensemble of quantum trajectories, preceded by a long transient propagation. We follow the ideology of event-driven programming and construct a new algorithmic realization of the method. The algorithm is computationally efficient, allowing for long "leaps" forward in time. It is also numerically exact, in the sense that, being given the list of uniformly distributed (on the unit interval) random numbers, {η_{1},η_{2},...,η_{n}}, one could propagate a quantum trajectory (with η_{i}'s as norm thresholds) in a numerically exact way. By using a scalable N-particle quantum model, we demonstrate that the algorithm allows us to resolve the asymptotic density operator of the model system with N=2000 states on a regular-size computer cluster, thus reaching the scale on which numerical studies of modulated Hamiltonian systems are currently performed.

DOI
10.1103/physreve.96.053313

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Quantum systems out of equilibrium are presently a subject of active research, both in theoretical and experimental domains. In this work, we consider time-periodically modulated quantum systems that are in contact with a stationary environment. Within the framework of a quantum master equation, the asymptotic states of such systems are described by time-periodic density operators. Resolution of these operators constitutes a nontrivial computational task. Approaches based on spectral and iterative methods are restricted to systems with the dimension of the hosting Hilbert space dimH=N≲300, while the direct long-time numerical integration of the master equation becomes increasingly problematic for N≳400, especially when the coupling to the environment is weak. To go beyond this limit, we use the quantum trajectory method, which unravels the master equation for the density operator into a set of stochastic processes for wave functions. The asymptotic density matrix is calculated by performing a statistical sampling over the ensemble of quantum trajectories, preceded by a long transient propagation. We follow the ideology of event-driven programming and construct a new algorithmic realization of the method. The algorithm is computationally efficient, allowing for long "leaps" forward in time. It is also numerically exact, in the sense that, being given the list of uniformly distributed (on the unit interval) random numbers, {η_{1},η_{2},...,η_{n}}, one could propagate a quantum trajectory (with η_{i}'s as norm thresholds) in a numerically exact way. By using a scalable N-particle quantum model, we demonstrate that the algorithm allows us to resolve the asymptotic density operator of the model system with N=2000 states on a regular-size computer cluster, thus reaching the scale on which numerical studies of modulated Hamiltonian systems are currently performed.
Modeling the non-equilibrium dissipative dynamics of strongly interacting quantized degrees of freedom is a fundamental problem in several branches of physics and chemistry. We implement a quantum state trajectory scheme for solving Lindblad quantum master equations that describe coherent and dissipative processes for a set of strongly coupled quantized oscillators. The scheme involves a sequence of stochastic quantum jumps with transition probabilities determined by the system state and the system-reservoir dynamics. Between consecutive jumps, the wave function is propagated in a coordinate space using the multi-configuration time-dependent Hartree method. We compare this hybrid propagation methodology with exact Liouville space solutions for physical systems of interest in cavity quantum electrodynamics, demonstrating accurate results for experimentally relevant observables using a tractable number of quantum trajectories. We show the potential for solving the dissipative dynamics of finite size arrays of strongly interacting quantized oscillators with high excitation densities, a scenario that is challenging for conventional density matrix propagators due to the large dimensionality of the underlying Hilbert space.
When a periodically modulated many-body quantum system is weakly coupled to an environment, the combined action of these temporal modulations and dissipation steers the system towards a state characterized by a time-periodic density operator. To resolve this asymptotic non-equilibrium state at stroboscopic instants of time, we use the dissipative propagator over one period of modulations, 'Floquet map', and evaluate the stroboscopic density operator as its invariant. Particle interactions control properties of the map and thus the features of its invariant. In addition, the spectrum of the map provides insight into the system relaxation towards the asymptotic state and may help to understand whether it is possible (or not) to construct a stroboscopic time-independent Lindblad generator which mimics the action of the original time-dependent one. We illustrate the idea with a scalable many-body model, a periodically modulated Bose–Hubbard dimer. We contrast the relations between the interaction-induced bifurcations in a mean-field description with the numerically exact stroboscopic evolution and discuss the characteristics of the genuine quantum many-body state vs the characteristics of its mean-field counterpart.
We describe a quantum trajectories technique for the unraveling of the quantum adiabatic master equation in Lindblad form. By evolving a complex state vector of dimension NNN instead of a complex density matrix of dimension N2{N}^{2}N2, simulations of larger system sizes become feasible. The cost of running many trajectories, which is required to recover the master equation evolution, can be minimized by running the trajectories in parallel, making this method suitable for high performance computing clusters. In general, the trajectories method can provide up to a factor NNN advantage over directly solving the master equation. In special cases where only the expectation values of certain observables are desired, an advantage of up to a factor N2{N}^{2}N2 is possible. We test the method by demonstrating agreement with direct solution of the quantum adiabatic master equation for 8-qubit quantum annealing examples. We also apply the quantum trajectories method to a 16-qubit example originally introduced to demonstrate the role of tunneling in quantum annealing, which is significantly more time consuming to solve directly using the master equation. The quantum trajectories method provides insight into individual quantum jump trajectories and their statistics, thus shedding light on open system quantum adiabatic evolution beyond the master equation.
It is well known that the state operator of an open quantum system can be generically represented as the solution of a time-local equation — a quantum master equation. Unraveling in quantum trajectories offers a picture of open system dynamics dual to solving master equations. In the unraveling picture, physical indicators are computed as Monte Carlo averages over a stochastic process valued in the Hilbert space of the system. This approach is particularly adapted to simulate systems in large Hilbert spaces. We show that the dynamics of an open quantum system generically admits an unraveling in the Hilbert space of the system described by a Markov process generated by ordinary stochastic differential equations for which rigorous concentration estimates are available. The unraveling can be equivalently formulated in terms of norm-preserving state vectors or in terms of linear “ostensible” processes trace preserving only on average. We illustrate the results in the case of a two level system in a simple boson environment. Next, we derive the state-of-the-art form of the Diósi-Gisin-Strunz Gaussian random ostensible state equation in the context of a model problem. This equation provides an exact unraveling of open systems in Gaussian environments. We compare and contrast the two unravelings and their potential for applications to quantum error mitigation.
Simulating the dynamics and the non-equilibrium steady state of an open quantum system are hard computational tasks on conventional computers. For the simulation of the time evolution, several efficient quantum algorithms have recently been developed. However, computing the non-equilibrium steady state as the long-time limit of the system dynamics is often not a viable solution, because of exceedingly long transient features or strong quantum correlations in the dynamics. Here, we develop an efficient quantum algorithm for the direct estimation of averaged expectation values of observables on the non-equilibrium steady state, thus bypassing the time integration of the master equation. The algorithm encodes the vectorized representation of the density matrix on a quantum register, and makes use of quantum phase estimation to approximate the eigenvector associated to the zero eigenvalue of the generator of the system dynamics. We show that the output state of the algorithm allows to estimate expectation values of observables on the steady state. Away from critical points, where the Liouvillian gap scales as a power law of the system size, the quantum algorithm performs with exponential advantage compared to exact diagonalization.
The asymptotic state of a periodically driven many-body quantum system in contact with an environment is investigated. The combined action of the driving and the environment steers the system towards a state being characterized by a time-periodic density operator. To compute this asymptotic non-equilibrium state at stroboscopic instants of time, we introduce the dissipative Floquet map, find the stroboscopic density operator as its eigen-operator and demonstrate how particle interactions affect properties of the density operator. We illustrate the idea with a periodically rocked open Bose-Hubbard dimer and discuss the relations between the interaction-induced bifurcation transitions in a mean-field dynamics and changes in the characteristics of the quantum many-body state. We argue that Floquet maps can provide insight into the system relaxation towards its asymptotic state and may help to identify the stroboscopic time-independent generator mimicking the action of the original time-dependent one.