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Net polarization of a molecular beam by strong electrostatic or radiative fields

机译:分子束在强静电场或辐射场作用下的净极化

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摘要

We present a simple analytic approximation for evaluating the ensemble-averaged orientation or alignment of a beam of molecules subjected to a strong static or radiative field. This approximation is based on the eigenproperties which polar or polarizable molecules exhibit in the strong-field, harmonic-librator limit, and on the Boltzmann statistics of the free rotor states which adiabatically correlate with the harmonic librator states. For either the permanent or induced dipole case, the resultant formula involves just two dimensionless parameters which characterize the strength of the molecule-field interaction and the rotational temperature. The net polarization of a molecular beam thus obtained is shown to be in an excellent agreement with the exact values computed numerically from first principles. The validity range of the approximation includes the large-interaction, high temperature regions of the parameter space where first-principle calculations are onerous.
机译:我们提出了一个简单的解析近似值,用于评估整体束的平均方向或排列在经受强静电场或辐射场的分子束中。这种近似基于极性或可极化分子在强场,谐波释放器极限中表现出的本征特性,以及与绝热与谐波释放器状态绝热相关的自由转子状态的玻耳兹曼统计量。对于永久或诱导偶极子情况,所得公式仅包含两个无量纲参数,这些参数表征了分子-场相互作用的强度和旋转温度。如此获得的分子束的净极化显示出与根据第一原理在数值上计算出的精确值非常一致。近似值的有效范围包括参数空间的大相互作用,高温区域,其中第一性原理的计算繁重。

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