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Simulating strong field control of axial chirality using optimal control theory

机译:使用最优控制理论模拟轴向手性的强场控制

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We propose a strong-field based method to control the chirality of molecules that exhibit torsion, illustrating the possibility of converting a racemate into a pure enantiomer at elevated temperatures. Optimal control theory is applied to design a laser pulse that will maximize the enantiomeric ratio achieved, considering both the case of a fixed, linear polarization and the case of a tunable polarization. Our simulations show the possibility of converting 99% and 99.5% of the population into a desired enantiomer for the fixed and tunable polarization solutions, respectively, deriving interesting insights regarding the conversion dynamics from the optimized pulse shape. Finally, we discuss several potential applications of the proposed approach, including a study of time-resolved racemization and a chiral switch.View full textDownload full textKeywordsoptimal control, strong field control, axial chirality, molecular torsionRelated var addthis_config = { ui_cobrand: "Taylor & Francis Online", services_compact: "citeulike,netvibes,twitter,technorati,delicious,linkedin,facebook,stumbleupon,digg,google,more", pubid: "ra-4dff56cd6bb1830b" }; Add to shortlist Link Permalink http://dx.doi.org/10.1080/00268976.2012.695808
机译:我们提出了一种基于强场的方法来控制表现出扭转力的分子的手性,说明了在高温下将外消旋体转化为纯对映体的可能性。最佳控制理论应用于设计一种激光脉冲,该脉冲将同时考虑固定线性偏振和可调谐偏振的情况,以使所获得的对映体比率最大化。我们的模拟表明,有可能将99%和99.5%的人口分别转换为固定和可调极化解决方案的所需对映异构体,从而从优化的脉冲形状中获得了有关转换动力学的有趣见解。最后,我们讨论了该方法的几种潜在应用,包括对时间分辨消旋和手性开关的研究。弗朗西斯在线”,services_compact:“ citeulike,netvibes,twitter,technorati,美味,linkedin,facebook,stumbleupon,digg,google,更多”,发布号:“ ra-4dff56cd6bb1830b”添加到候选列表链接永久链接http://dx.doi.org/10.1080/00268976.2012.695808

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