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A Simplified Approach to Optimally Controlled Quantum Dynamics

机译:最优控制量子动力学的简化方法

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摘要

A new formalism for the optimal control of quantum mechanical physical observables is presented. This approach is based on an analogous classical control technique reported previously[J. Botina, H. Rabitz and N. Rahman, J. chem. Phys. Vol. 102, pag. 226 (1995)]. Quantum Lagrange multiplier functions are used to preserve a chosen subset of the observable dynamics of interest. As a result, a corresponding small set of Lagrange multipliers needs to be calculated and they are only a function of time. This is a considerable simplification over traditional quantum optimal control theory[S. shi and H. Rabitz, comp. Phys. Comm. Vol. 63, pag. 71 (1991)]. The success of the new approach is based on taking advantage of the multiplicity of solutions to virtually any problem of quantum control to meet a physical objective. A family of such simplified formulations is introduced and numerically tested. Results are presented for these algorithms and compared with previous reported work on a model problem for selective unimolecular reaction induced by an external optical electric field.
机译:提出了一种量子力学物理观测值的最优控制新形式。这种方法是基于先前报道的类似的经典控制技术[J]。 Botina,H。Rabitz和N. Rahman,J。chem。物理卷102,页226(1995)]。量子拉格朗日乘数函数用于保留感兴趣的可观察动态的选定子集。结果,需要计算相应的一小套拉格朗日乘数,它们只是时间的函数。与传统的量子最优控制理论相比,这是一个相当大的简化。 shi和H. Rabitz,比较。物理通讯卷63,PAG。 71(1991)]。新方法的成功基于对几乎任何量子控制问题的解决方案的多样性,以达到物理目的。引入了一系列此类简化配方并进行了数值测试。给出了这些算法的结果,并与先前报道的关于由外部光电场引起的选择性单分子反应的模型问题的工作进行了比较。

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