分子定位与取向:从激光诱导机制到最优控制

CRM Workshop Pub Date : 2002-12-19 DOI:10.1090/crmp/033/01
O. Atabek, C. Dion
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引用次数: 1

摘要

遗传算法作为最优控制策略的实现,目前已成功地应用于分子物理的广泛问题中。在这种情况下,激光控制分子的排列和取向仍然是一个非常有前途的问题,具有挑战性的应用范围从化学反应性延伸到纳米级设计。我们强调监测对准/取向过程的基本量子机制与最优控制场景之间的互补性。更明确地说,如果一方面我们可以通过适当地建立目标和描述参数采样空间来帮助最优控制方案利用这些机制,另一方面我们期望从最优控制结果中学习到一些鲁棒的和物理上健全的动力机制。我们提出了排列和取向的基本机制,如分子加场有效势所调节的摆态和由突然激发获得的“踢”机制。非常有趣的是,一种基于遗传算法的定向最优控制方案也会导致具有踢臂机构特征的突然脉冲场。我们未来的发展方向是实现高效和持久定向的最佳脉冲整形,以及对温度效应的鲁棒性。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Molecular alignment and orientation: From laser-induced mechanisms to optimal control
Genetic algorithms, as implemented in optimal control strategies, are currently successfully exploited in a wide range of problems in molecular physics. In this context, laser control of molecular alignment and orientation remains a very promising issue with challenging applications extending from chemical reactivity to nanoscale design. We emphasize the complementarity between basic quantum mechanisms monitoring alignment/orientation processes and optimal control scenarios. More explicitly, if on one hand we can help the optimal control scheme to take advantage of such mechanisms by appropriately building the targets and delineating the parameter sampling space, on the other hand we expect to learn, from optimal control results, some robust and physically sound dynamical mechanisms. We present basic mechanisms for alignment and orientation, such as pendular states accommodated by the molecule-plus-field effective potential and the "kick" mechanism obtained by a sudden excitation. Very interestingly, an optimal control scheme for orientation, based on genetic algorithms, also leads to a sudden pulsed field bearing the characteristic features of the kick mechanism. Optimal pulse shaping for very efficient and long-lasting orientation, together with robustness with respect to temperature effects, are among our future prospects.
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