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Journal of Physics A Mathematical and General

Optimal control of quantum systems: a projection approach

Chao-Jung Cheng, Chi-Chuan Hwang, Teh‐Lu Liao, Gen-Liang Chou

Published Jan 14, 2005• 2 citations
Publisher

Abstract

This paper considers the optimal control of quantum systems. The controlled quantum systems are described by the probability-density-matrix-based Liouville–von Neumann equation. Using projection operators, the states of the quantum system are decomposed into two sub-spaces, namely the 'main state' space and the 'remaining state' space. Since the control energy is limited, a solution for optimizing the external control force is proposed in which the main state is brought to the desired main state at a certain target time, while the population of the remaining state is simultaneously suppressed in order to diminish its effects on the final population of the main state. The optimization problem is formulated by maximizing a general cost functional of states and control force. An efficient algorithm is developed to solve the optimization problem. Finally, using the hydrogen fluoride (HF) molecular population transfer problem as an illustrative example, the effectiveness of the proposed scheme for a quantum system initially in a mixed state or in a pure state is investigated through numerical simulations.

DOI
10.1088/0305-4470/38/4/012

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This paper considers the optimal control of quantum systems. The controlled quantum systems are described by the probability-density-matrix-based Liouville–von Neumann equation. Using projection operators, the states of the quantum system are decomposed into two sub-spaces, namely the 'main state' space and the 'remaining state' space. Since the control energy is limited, a solution for optimizing the external control force is proposed in which the main state is brought to the desired main state at a certain target time, while the population of the remaining state is simultaneously suppressed in order to diminish its effects on the final population of the main state. The optimization problem is formulated by maximizing a general cost functional of states and control force. An efficient algorithm is developed to solve the optimization problem. Finally, using the hydrogen fluoride (HF) molecular population transfer problem as an illustrative example, the effectiveness of the proposed scheme for a quantum system initially in a mixed state or in a pure state is investigated through numerical simulations.
The optimal control of the path to a specified final state of a quantum-mechanical system is investigated. The problem is formulated as a minimization problem over appropriate function spaces, and the well-posedness of this problem is is established by proving the existence of an optimal solution. A Lagrange-multiplier technique is used to reduce the problem to an equivalent optimization problem and to derive necessary conditions for a minimum. These necessary conditions form the basis for a gradient iterative procedure to search for a minimum. A numerical scheme based on finite differences is used to reduce the infinite-dimensional minimization problem to an approximate finite-dimensional problem. Numerical examples are provided for final-state control of a diatomic molecule represented by a Morse potential. Within the context of this optimal control formulation, numerical results are given for the optimal pulsing strategy to demonstrate the feasibility of wave-packet control and finally to achieve a specified dissociative wave packet at a given time. The optimal external optical fields generally have a high degree of structure, including an early time period of wave-packet phase adjustment followed by a period of extensive energy deposition to achieve the imposed objective. Constraints on the form of the molecular dipole (e.g., a linear dipole) are shown to limit the accessibility (i.e., controllability) of certain types of molecular wave-packet objectives. The nontrivial structure of the optimal pulse strategies emphasizes the ultimate usefulness of an optimal-control approach to the steering of quantum systems to desired objectives.
An optimal control theory for open quantum systems is constructed containing non-Markovian dissipation manipulated by an external control field. The control theory is developed based on a novel quantum dissipation formulation that treats both the initial canonical ensemble and the subsequent reduced control dynamics. An associated scheme of backward propagation is presented, allowing the efficient evaluation of general optimal control problems. As an illustration, the control theory is applied to the vibration of the hydrogen fluoride molecule embedded in a non-Markovian dissipative medium. The importance of control-dissipation correlation is evident in the results.
In order to solve the state of an open quantum system with relaxation and dissipation,the dynamical equation of the system in matrix was transformed into vector form in Liouville space. Taking the expectation value for the state under control reaching the target state as performance indicators,an optimal control function was derived for the system transformed. The control a 2-level open quantum system was simulated on in MATLAB. The influence to population transfer probability and control time caused by changing of parameters were analysed contrastively.
A general scheme is presented for controlling quantum systems using evolution driven by nonselective von Neumann measurements, with or without an additional tailored electromagnetic field. As an example, a two-level quantum system controlled by nonselective quantum measurements is considered. The control goal is to find optimal system observables such that consecutive nonselective measurement of these observables transforms the system from a given initial state into a state which maximizes the expected value of a target operator (the objective). A complete analytical solution is found including explicit expressions for the optimal measured observables and for the maximal objective value given any target operator, any initial system density matrix, and any number of measurements. As an illustration, upper bounds on measurement-induced population transfer between the ground and the excited states for any number of measurements are found. The anti-Zeno effect is recovered in the limit of an infinite number of measurements. In this limit the system becomes completely controllable. The results establish the degree of control attainable by a finite number of measurements.
We investigate the problem of control of quantum systems. Various notions of controllability of quantum systems are discussed and Lie algebraic techniques are employed to derive necessary and sufficient conditions for the resulting degrees of controllability. The results are employed to study the degree of controllability for various model systems. The problem of optimal control is formulated as a problem of maximisation of the expectation value of an observable of the system subject to dynamical constraints and costs. A class of iterative algorithms is discussed, and shown to converge to a solution of the Euler-Lagrange equations, which is a necessary condition for optimality of a solution. A numerical realisation of the algorithm is presented and potential implementation of the resulting control fields in the laboratory is discussed. The algorithm is applied to find optimal control fields for a variety of applications including selective and simultaneous excitation of individual quantum dots in a globally addressed ensemble, creation of superposition states, and selective excitation of certain vibrational modes of a simple molecule such as Hydrogen Fluoride. In each case we systematically explore the parameter space of the algorithm to select solutions with desirable physical features from the multitude of possible choices. As there are many possible optimal control fields which give similar yields the question of whether some are more robust than others is investigated. A number of optimal fields are analysed quantitatively in terms of robustness with regard to temporal and spectral noise affecting the fields, uncertainty in the model parameters and the effect of experimental limitations such as restrictions on the bandwidth of the fields. It is shown that whilst the solutions tend to be sensitive to uncertainty in the energy levels chosen for the model, they appear to be surprisingly tolerant to even severe bandwidth limitations.
In this paper we have synthesized optimal control of multi-level quantum system by representing unitary operator in terms of the projection operators of the Hamiltonian of the system. We have solved the steering problem for multi-level quantum systems minimizing energy cost functional of the control. The optimal control problem of the time evolution of quantum spin of Pauli two-level system subjected to an external field with the minimum energy function is also illustrated and formulated in terms of the quantum spin up and spin down states of the Pauli two-level system.