4.7 Article

Time-dependent analysis of the mixed-field orientation of molecules without rotational symmetry

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JOURNAL OF CHEMICAL PHYSICS
卷 146, 期 24, 页码 -

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AMER INST PHYSICS
DOI: 10.1063/1.4986954

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资金

  1. Helmholtz Association
  2. Deutsche Forschungsgemeinschaft (DFG) through the excellence cluster The Hamburg Center for Ultrafast Imaging-Structure, Dynamics and Control of Matter at the Atomic Scale (CUI) [EXC1074]
  3. European Research Council through the Consolidator Grant COMOTION [ERC-Kupper-614507]
  4. Spanish Project [FIS2014-54497-P]
  5. Andalusian research group [FQM-207, P11-FQM-7276]

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We present a theoretical study of the mixed-field orientation of molecules without rotational symmetry. The time-dependent one-dimensional and three-dimensional orientation of a thermal ensemble of 6-chloropyridazine-3-carbonitrile molecules in combined linearly or elliptically polarized laser fields and tilted dc electric fields is computed. The results are in good agreement with recent experimental results of one-dimensional orientation for weak dc electric fields [J. L. Hansen, J. Chem. Phys. 139, 234313 (2013)]. Moreover, they predict that using elliptically polarized laser fields or strong dc fields, three-dimensional orientation is obtained. The field-dressed dynamics of excited rotational states is characterized by highly non-adiabatic effects. We analyze the sources of these non-adiabatic effects and investigate their impact on the mixed-field orientation for different field configurations in mixed-field- orientation experiments. Published by AIP Publishing.

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