Vibrational and nonlinear optical properties of amine-capped push-pull polyynes by infrared and Raman spectroscopy

@article{Marabotti2021VibrationalAN,
  title={Vibrational and nonlinear optical properties of amine-capped push-pull polyynes by infrared and Raman spectroscopy},
  author={P. Marabotti and Alberto Milani and Andrea Lucotti and Luigi Brambilla and Matteo Tommasini and Chiara Castiglioni and Patrycja Mkecik and Bartłomiej Pigulski and Sławomir Szafert and Carlo Spartaco Casari},
  journal={Carbon Trends},
  year={2021}
}
The vibrational properties of a series of push-pull polyynes have been studied by infrared and Raman spectroscopy. The simultaneous activation of a strong infrared and Raman mode, i.e. the collective vibration of CC bonds of the sp carbon chain, suggests the occurrence of attractive nonlinear optical properties. The optical, electronic, and vibrational properties of these molecules have been investigated with the support of density functional theory calculations, as well as the electronic and… 

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